N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(2-oxidanylidene-3-propyl-benzimidazol-1-yl)propanamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(2-oxidanylidene-3-propyl-benzimidazol-1-yl)propanamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(2-oxo-3-propyl-benzimidazol-1-yl)propanamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-3-(2-oxo-3-propyl-1-benzimidazolyl)propanamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-3-(2-keto-3-propyl-benzimidazol-1-yl)propionamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N(C1=O)CCC(=O)NCCSCC3=CC=CC=C3C#N

Isomeric SMILES

CCCN1C2=CC=CC=C2N(C1=O)CCC(=O)NCCSCC3=CC=CC=C3C#N

InChI

InChI=1S/C23H26N4O2S/c1-2-13-26-20-9-5-6-10-21(20)27(23(26)29)14-11-22(28)25-12-15-30-17-19-8-4-3-7-18(19)16-24/h3-10H,2,11-15,17H2,1H3,(H,25,28)