N-[1-oxidanylidene-1-(phenethylamino)-3-phenylsulfanyl-propan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide

Systemtic Name: N-[1-oxidanylidene-1-(phenethylamino)-3-phenylsulfanyl-propan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide Openeye Name: N-[2-oxo-2-(phenethylamino)-1-(phenylsulfanylmethyl)ethyl]-2-(4-pyridyl)-3H-benzimidazole-5-carboxamide CAS Name: N-[1-oxo-1-(phenethylamino)-3-(phenylthio)propan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide IUPAC Name: N-[1-oxo-1-(phenethylamino)-3-phenylsulfanylpropan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide Traditional Name: N-[2-keto-2-(phenethylamino)-1-[(phenylthio)methyl]ethyl]-2-(4-pyridyl)-3H-benzimidazole-5-carboxamide Formula: C30H27N5O2S MolecularWeight: 521.63268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C(CSC2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)N=C(N4)C5=CC=NC=C5

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C(CSC2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)N=C(N4)C5=CC=NC=C5

InChI

InChI=1S/C30H27N5O2S/c36-29(23-11-12-25-26(19-23)34-28(33-25)22-14-16-31-17-15-22)35-27(20-38-24-9-5-2-6-10-24)30(37)32-18-13-21-7-3-1-4-8-21/h1-12,14-17,19,27H,13,18,20H2,(H,32,37)(H,33,34)(H,35,36)