N-[2-(phenylmethylsulfanyl)ethyl]-4-pyrrol-1-yl-benzamide

Systemtic Name: N-[2-(phenylmethylsulfanyl)ethyl]-4-pyrrol-1-yl-benzamide Openeye Name: N-(2-benzylsulfanylethyl)-4-pyrrol-1-yl-benzamide CAS Name: N-[2-(phenylmethylthio)ethyl]-4-(1-pyrrolyl)benzamide IUPAC Name: N-(2-benzylsulfanylethyl)-4-pyrrol-1-ylbenzamide Traditional Name: N-[2-(benzylthio)ethyl]-4-pyrrol-1-yl-benzamide Formula: C20H20N2OS MolecularWeight: 336.4506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCNC(=O)C2=CC=C(C=C2)N3C=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CSCCNC(=O)C2=CC=C(C=C2)N3C=CC=C3

InChI

InChI=1S/C20H20N2OS/c23-20(21-12-15-24-16-17-6-2-1-3-7-17)18-8-10-19(11-9-18)22-13-4-5-14-22/h1-11,13-14H,12,15-16H2,(H,21,23)