N-[[2-(4-methylpiperazin-1-yl)carbonylphenyl]carbamothioyl]-2-phenyl-ethanamide

Systemtic Name: N-[[2-(4-methylpiperazin-1-yl)carbonylphenyl]carbamothioyl]-2-phenyl-ethanamide Openeye Name: N-[[2-(4-methylpiperazine-1-carbonyl)phenyl]carbamothioyl]-2-phenyl-acetamide CAS Name: N-[[2-[(4-methyl-1-piperazinyl)-oxomethyl]anilino]-sulfanylidenemethyl]-2-phenylacetamide IUPAC Name: N-[[2-(4-methylpiperazine-1-carbonyl)phenyl]carbamothioyl]-2-phenylacetamide Traditional Name: N-[[2-(4-methylpiperazine-1-carbonyl)phenyl]thiocarbamoyl]-2-phenyl-acetamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H24N4O2S/c1-24-11-13-25(14-12-24)20(27)17-9-5-6-10-18(17)22-21(28)23-19(26)15-16-7-3-2-4-8-16/h2-10H,11-15H2,1H3,(H2,22,23,26,28)