N-(2,3-dimethylphenyl)-2-[2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylethanoylamino]ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-[2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylethanoylamino]ethanamide Openeye Name: 2-[[2-(1-allylbenzimidazol-2-yl)sulfanylacetyl]amino]-N-(2,3-dimethylphenyl)acetamide CAS Name: N-(2,3-dimethylphenyl)-2-[[1-oxo-2-[(1-prop-2-enyl-2-benzimidazolyl)thio]ethyl]amino]acetamide IUPAC Name: N-(2,3-dimethylphenyl)-2-[[2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetyl]amino]acetamide Traditional Name: 2-[[2-[(1-allylbenzimidazol-2-yl)thio]acetyl]amino]-N-(2,3-dimethylphenyl)acetamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CNC(=O)CSC2=NC3=CC=CC=C3N2CC=C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CNC(=O)CSC2=NC3=CC=CC=C3N2CC=C)C

InChI

InChI=1S/C22H24N4O2S/c1-4-12-26-19-11-6-5-9-18(19)25-22(26)29-14-21(28)23-13-20(27)24-17-10-7-8-15(2)16(17)3/h4-11H,1,12-14H2,2-3H3,(H,23,28)(H,24,27)