4-[[2-[2-[(2,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoyl-methyl-amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[2-[2-[(2,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoyl-methyl-amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[[2-[2-(2,4-dimethylanilino)-2-oxo-ethyl]sulfanylacetyl]-methyl-amino]methyl]-N-methyl-benzamide CAS Name: 4-[[[2-[[2-(2,4-dimethylanilino)-2-oxoethyl]thio]-1-oxoethyl]-methylamino]methyl]-N-methylbenzamide IUPAC Name: 4-[[[2-[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanylacetyl]-methylamino]methyl]-N-methylbenzamide Traditional Name: 4-[[[2-[[2-(2,4-dimethylanilino)-2-keto-ethyl]thio]acetyl]-methyl-amino]methyl]-N-methyl-benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSCC(=O)N(C)CC2=CC=C(C=C2)C(=O)NC)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSCC(=O)N(C)CC2=CC=C(C=C2)C(=O)NC)C

InChI

InChI=1S/C22H27N3O3S/c1-15-5-10-19(16(2)11-15)24-20(26)13-29-14-21(27)25(4)12-17-6-8-18(9-7-17)22(28)23-3/h5-11H,12-14H2,1-4H3,(H,23,28)(H,24,26)