2,2-dimethyl-N-[4-[2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylethanoyl]phenyl]propanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3O2S/c1-5-14-26-19-9-7-6-8-18(19)25-22(26)29-15-20(27)16-10-12-17(13-11-16)24-21(28)23(2,3)4/h5-13H,1,14-15H2,2-4H3,(H,24,28)