2-(1-phenethylbenzimidazol-2-yl)sulfanyl-N-(prop-2-enylcarbamoyl)ethanamide

Systemtic Name: 2-(1-phenethylbenzimidazol-2-yl)sulfanyl-N-(prop-2-enylcarbamoyl)ethanamide Openeye Name: N-(allylcarbamoyl)-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[oxo-(prop-2-enylamino)methyl]-2-[(1-phenethyl-2-benzimidazolyl)thio]acetamide IUPAC Name: 2-(1-phenethylbenzimidazol-2-yl)sulfanyl-N-(prop-2-enylcarbamoyl)acetamide Traditional Name: N-(allylcarbamoyl)-2-[(1-phenethylbenzimidazol-2-yl)thio]acetamide Formula: C21H22N4O2S MolecularWeight: 394.48998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)CSC1=NC2=CC=CC=C2N1CCC3=CC=CC=C3

Isomeric SMILES

C=CCNC(=O)NC(=O)CSC1=NC2=CC=CC=C2N1CCC3=CC=CC=C3

InChI

InChI=1S/C21H22N4O2S/c1-2-13-22-20(27)24-19(26)15-28-21-23-17-10-6-7-11-18(17)25(21)14-12-16-8-4-3-5-9-16/h2-11H,1,12-15H2,(H2,22,24,26,27)