2-[4-[2-(3,4-dimethylphenyl)sulfanylethanoyl]piperazin-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-[2-(3,4-dimethylphenyl)sulfanylethanoyl]piperazin-1-yl]-N-propan-2-yl-ethanamide Openeye Name: 2-[4-[2-(3,4-dimethylphenyl)sulfanylacetyl]piperazin-1-yl]-N-isopropyl-acetamide CAS Name: 2-[4-[2-[(3,4-dimethylphenyl)thio]-1-oxoethyl]-1-piperazinyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-[2-(3,4-dimethylphenyl)sulfanylacetyl]piperazin-1-yl]-N-propan-2-ylacetamide Traditional Name: 2-[4-[2-[(3,4-dimethylphenyl)thio]acetyl]piperazino]-N-isopropyl-acetamide Formula: C19H29N3O2S MolecularWeight: 363.51746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCC(=O)N2CCN(CC2)CC(=O)NC(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCC(=O)N2CCN(CC2)CC(=O)NC(C)C)C

InChI

InChI=1S/C19H29N3O2S/c1-14(2)20-18(23)12-21-7-9-22(10-8-21)19(24)13-25-17-6-5-15(3)16(4)11-17/h5-6,11,14H,7-10,12-13H2,1-4H3,(H,20,23)