N,N-dimethyl-2-[2-[4-(pyridin-4-ylmethyl)piperazin-1-yl]carbonylphenyl]sulfanyl-ethanamide

Systemtic Name: N,N-dimethyl-2-[2-[4-(pyridin-4-ylmethyl)piperazin-1-yl]carbonylphenyl]sulfanyl-ethanamide Openeye Name: N,N-dimethyl-2-[2-[4-(4-pyridylmethyl)piperazine-1-carbonyl]phenyl]sulfanyl-acetamide CAS Name: N,N-dimethyl-2-[[2-[oxo-[4-(pyridin-4-ylmethyl)-1-piperazinyl]methyl]phenyl]thio]acetamide IUPAC Name: N,N-dimethyl-2-[2-[4-(pyridin-4-ylmethyl)piperazine-1-carbonyl]phenyl]sulfanylacetamide Traditional Name: N,N-dimethyl-2-[[2-[4-(4-pyridylmethyl)piperazine-1-carbonyl]phenyl]thio]acetamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CSC1=CC=CC=C1C(=O)N2CCN(CC2)CC3=CC=NC=C3

Isomeric SMILES

CN(C)C(=O)CSC1=CC=CC=C1C(=O)N2CCN(CC2)CC3=CC=NC=C3

InChI

InChI=1S/C21H26N4O2S/c1-23(2)20(26)16-28-19-6-4-3-5-18(19)21(27)25-13-11-24(12-14-25)15-17-7-9-22-10-8-17/h3-10H,11-16H2,1-2H3