(2S)-2-[2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]-N-propyl-propanamide

Systemtic Name: (2S)-2-[2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]-N-propyl-propanamide Openeye Name: (2S)-2-[[2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]-N-propyl-propanamide CAS Name: (2S)-2-[[2-[(6-methyl-1H-benzimidazol-2-yl)thio]-1-oxoethyl]amino]-N-propylpropanamide IUPAC Name: (2S)-2-[[2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]-N-propylpropanamide Traditional Name: (2S)-2-[[2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetyl]amino]-N-propyl-propionamide Formula: C16H22N4O2S MolecularWeight: 334.43648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)CSC1=NC2=C(N1)C=C(C=C2)C

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)CSC1=NC2=C(N1)C=C(C=C2)C

InChI

InChI=1S/C16H22N4O2S/c1-4-7-17-15(22)11(3)18-14(21)9-23-16-19-12-6-5-10(2)8-13(12)20-16/h5-6,8,11H,4,7,9H2,1-3H3,(H,17,22)(H,18,21)(H,19,20)/t11-/m0/s1