3-methyl-N-[4-[2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylethanoyl]phenyl]butanamide

Systemtic Name: 3-methyl-N-[4-[2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylethanoyl]phenyl]butanamide Openeye Name: N-[4-[2-(1-allylbenzimidazol-2-yl)sulfanylacetyl]phenyl]-3-methyl-butanamide CAS Name: 3-methyl-N-[4-[1-oxo-2-[(1-prop-2-enyl-2-benzimidazolyl)thio]ethyl]phenyl]butanamide IUPAC Name: 3-methyl-N-[4-[2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetyl]phenyl]butanamide Traditional Name: N-[4-[2-[(1-allylbenzimidazol-2-yl)thio]acetyl]phenyl]-3-methyl-butyramide Formula: C23H25N3O2S MolecularWeight: 407.5285

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3N2CC=C

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3N2CC=C

InChI

InChI=1S/C23H25N3O2S/c1-4-13-26-20-8-6-5-7-19(20)25-23(26)29-15-21(27)17-9-11-18(12-10-17)24-22(28)14-16(2)3/h4-12,16H,1,13-15H2,2-3H3,(H,24,28)