N-[3-(azepan-1-yl)propyl]-4-(3H-imidazo[4,5-c]pyridin-2-ylsulfanylmethyl)benzamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-4-(3H-imidazo[4,5-c]pyridin-2-ylsulfanylmethyl)benzamide Openeye Name: N-[3-(azepan-1-yl)propyl]-4-(3H-imidazo[4,5-c]pyridin-2-ylsulfanylmethyl)benzamide CAS Name: N-[3-(1-azepanyl)propyl]-4-[(3H-imidazo[4,5-c]pyridin-2-ylthio)methyl]benzamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-4-(3H-imidazo[4,5-c]pyridin-2-ylsulfanylmethyl)benzamide Traditional Name: N-[3-(azepan-1-yl)propyl]-4-[(3H-imidazo[4,5-c]pyridin-2-ylthio)methyl]benzamide Formula: C23H29N5OS MolecularWeight: 423.57426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCNC(=O)C2=CC=C(C=C2)CSC3=NC4=C(N3)C=NC=C4

Isomeric SMILES

C1CCCN(CC1)CCCNC(=O)C2=CC=C(C=C2)CSC3=NC4=C(N3)C=NC=C4

InChI

InChI=1S/C23H29N5OS/c29-22(25-11-5-15-28-13-3-1-2-4-14-28)19-8-6-18(7-9-19)17-30-23-26-20-10-12-24-16-21(20)27-23/h6-10,12,16H,1-5,11,13-15,17H2,(H,25,29)(H,26,27)