2-[methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]amino]-N-(4-pyrrolidin-1-ylphenyl)ethanamide

Systemtic Name: 2-[methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]amino]-N-(4-pyrrolidin-1-ylphenyl)ethanamide Openeye Name: 2-[methyl-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]amino]-N-(4-pyrrolidin-1-ylphenyl)acetamide CAS Name: 2-[methyl-[2-[2-(methylthio)anilino]-2-oxoethyl]amino]-N-[4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-[methyl-[2-(2-methylsulfanylanilino)-2-oxoethyl]amino]-N-(4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-[[2-keto-2-[2-(methylthio)anilino]ethyl]-methyl-amino]-N-(4-pyrrolidinophenyl)acetamide Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=C(C=C1)N2CCCC2)CC(=O)NC3=CC=CC=C3SC

Isomeric SMILES

CN(CC(=O)NC1=CC=C(C=C1)N2CCCC2)CC(=O)NC3=CC=CC=C3SC

InChI

InChI=1S/C22H28N4O2S/c1-25(16-22(28)24-19-7-3-4-8-20(19)29-2)15-21(27)23-17-9-11-18(12-10-17)26-13-5-6-14-26/h3-4,7-12H,5-6,13-16H2,1-2H3,(H,23,27)(H,24,28)