N-(3,4-dimethylphenyl)-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfinyl-ethanamide

Systemtic Name: N-(3,4-dimethylphenyl)-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfinyl-ethanamide Openeye Name: N-(3,4-dimethylphenyl)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfinyl-acetamide CAS Name: N-(3,4-dimethylphenyl)-2-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]sulfinylacetamide IUPAC Name: N-(3,4-dimethylphenyl)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfinylacetamide Traditional Name: N-(3,4-dimethylphenyl)-2-[2-keto-2-(4-phenylpiperazino)ethyl]sulfinyl-acetamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CS(=O)CC(=O)N2CCN(CC2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CS(=O)CC(=O)N2CCN(CC2)C3=CC=CC=C3)C

InChI

InChI=1S/C22H27N3O3S/c1-17-8-9-19(14-18(17)2)23-21(26)15-29(28)16-22(27)25-12-10-24(11-13-25)20-6-4-3-5-7-20/h3-9,14H,10-13,15-16H2,1-2H3,(H,23,26)