6-(1,3-benzodioxol-5-yl)-N-methyl-N-[(2-methyl-4-thiazolyl)methyl]-4-quinazolinamine (Q27163907)

CHEMBL1474834 (English)

9 October 2016

chemical formula

C₂₁H₁₈N₄O₂S

1 reference

CHEMBL1474834 (English)

9 October 2016

canonical SMILES

CC1=NC(=CS1)CN(C)C2=NC=NC3=C2C=C(C=C3)C4=CC5=C(C=C4)OCO5

1 reference

CHEMBL1474834 (English)

InChI=1S/C21H18N4O2S/c1-13-24-16(10-28-13)9-25(2)21-17-7-14(3-5-18(17)22-11-23-21)15-4-6-19-20(8-15)27-12-26-19/h3-8,10-11H,9,12H2,1-2H3

9 October 2016

Identifiers

InChI

1 reference

CHEMBL1474834 (English)

PMDAVRLCSZSLRH-UHFFFAOYSA-N

9 October 2016

InChIKey

2 references

CHEMBL1474834 (English)

9 October 2016

stated in

ChEBI release 2020-09-01

1 reference

6-(1,3-Benzodioxol-5-yl)-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-4-quinazolinamine (English)

9 October 2016

1 reference

CHEMBL1474834 (English)

9 October 2016

ChEBI ID

92117

mapping relation type

2 references

6-(1,3-benzodioxol-5-yl)-N-methyl-N-[(2-methyl-4-thiazolyl)methyl]-4-quinazolinamine (English)

matched by identifier from

9 October 2016

International Chemical Identifier

InChI

InChI=1S/C21H18N4O2S/c1-13-24-16(10-28-13)9-25(2)21-17-7-14(3-5-18(17)22-11-23-21)15-4-6-19-20(8-15)27-12-26-19/h3-8,10-11H,9,12H2,1-2H3

1 reference