1H-1,4-Benzodiazepine-7-carbonitrile, 2,3-dihydro-1-methyl-2-oxo-5-phenyl- (Q83060257)

chemical compound

Language	Label	Description	Also known as
English	1H-1,4-Benzodiazepine-7-carbonitrile, 2,3-dihydro-1-methyl-2-oxo-5-phenyl-	chemical compound

Statements

instance of

type of chemical entity

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subclass of

chemical compound

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mass

275.105862036 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₇H₁₃N₃O

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CN1C(=O)CN=C(c2ccccc2)c2cc(C#N)ccc21

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C17H13N3O/c1-20-15-8-7-12(10-18)9-14(15)17(19-11-16(20)21)13-5-3-2-4-6-13/h2-9H,11H2,1H3

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InChIKey

PMDUNHOOULGNCQ-UHFFFAOYSA-N

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CAS Registry Number

3489-59-6

1 reference

InChIKey

PMDUNHOOULGNCQ-UHFFFAOYSA-N

9 April 2021

https://commonchemistry.cas.org/detail?cas_rn=3489-59-6

1 reference

26 December 2021

1 reference

0 references

DSSTOX compound identifier

DTXCID00110936

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1H-1,4-Benzodiazepine-7-carbonitrile, 2,3-dihydro-1-methyl-2-oxo-5-phenyl- (Q83060257)

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1H-1,4-Benzodiazepine-7-carbonitrile, 2,3-dihydro-1-methyl-2-oxo-5-phenyl- (Q83060257)

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