1-[4-(1H-benzimidazol-2-yl)phenyl]-3-[3-(4-morpholinyl)propyl]thiourea (Q27193546)

MLS000770866 (English)

11 October 2016

chemical formula

C₂₁H₂₅N₅OS

1 reference

MLS000770866 (English)

11 October 2016

canonical SMILES

C1COCCN1CCCNC(=S)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4N3

1 reference

MLS000770866 (English)

InChI=1S/C21H25N5OS/c28-21(22-10-3-11-26-12-14-27-15-13-26)23-17-8-6-16(7-9-17)20-24-18-4-1-2-5-19(18)25-20/h1-2,4-9H,3,10-15H2,(H,24,25)(H2,22,23,28)

11 October 2016

Identifiers

InChI

1 reference

MLS000770866 (English)

CEGPLYZCVFIDPM-UHFFFAOYSA-N

11 October 2016

InChIKey

2 references

MLS000770866 (English)

11 October 2016

stated in

ChEBI release 2020-09-01

1 reference

1-[4-(1H-Benzimidazol-2-yl)phenyl]-3-[3-(4-morpholinyl)propyl]thiourea (English)

11 October 2016

2 references

MLS000770866 (English)

matched by identifier from

11 October 2016

InChIKey

CEGPLYZCVFIDPM-UHFFFAOYSA-N

ChEBI ID

113082

mapping relation type

2 references

1-[4-(1H-benzimidazol-2-yl)phenyl]-3-[3-(4-morpholinyl)propyl]thiourea (English)

matched by identifier from

11 October 2016

International Chemical Identifier

InChI

InChI=1S/C21H25N5OS/c28-21(22-10-3-11-26-12-14-27-15-13-26)23-17-8-6-16(7-9-17)20-24-18-4-1-2-5-19(18)25-20/h1-2,4-9H,3,10-15H2,(H,24,25)(H2,22,23,28)

1 reference