N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-2-(1-methylbenzimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-2-(1-methylbenzimidazol-2-yl)sulfanyl-propanamide Openeye Name: N-[2-(2-ethylanilino)-2-oxo-ethyl]-N-methyl-2-(1-methylbenzimidazol-2-yl)sulfanyl-propanamide CAS Name: N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-[(1-methyl-2-benzimidazolyl)thio]propanamide IUPAC Name: N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(1-methylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: N-[2-(2-ethylanilino)-2-keto-ethyl]-N-methyl-2-[(1-methylbenzimidazol-2-yl)thio]propionamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CN(C)C(=O)C(C)SC2=NC3=CC=CC=C3N2C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CN(C)C(=O)C(C)SC2=NC3=CC=CC=C3N2C

InChI

InChI=1S/C22H26N4O2S/c1-5-16-10-6-7-11-17(16)23-20(27)14-25(3)21(28)15(2)29-22-24-18-12-8-9-13-19(18)26(22)4/h6-13,15H,5,14H2,1-4H3,(H,23,27)