3-(2-chlorophenyl)-N-[[2-(4-methylpiperazin-1-yl)carbonylphenyl]carbamothioyl]propanamide

Systemtic Name: 3-(2-chlorophenyl)-N-[[2-(4-methylpiperazin-1-yl)carbonylphenyl]carbamothioyl]propanamide Openeye Name: 3-(2-chlorophenyl)-N-[[2-(4-methylpiperazine-1-carbonyl)phenyl]carbamothioyl]propanamide CAS Name: 3-(2-chlorophenyl)-N-[[2-[(4-methyl-1-piperazinyl)-oxomethyl]anilino]-sulfanylidenemethyl]propanamide IUPAC Name: 3-(2-chlorophenyl)-N-[[2-(4-methylpiperazine-1-carbonyl)phenyl]carbamothioyl]propanamide Traditional Name: 3-(2-chlorophenyl)-N-[[2-(4-methylpiperazine-1-carbonyl)phenyl]thiocarbamoyl]propionamide Formula: C22H25ClN4O2S MolecularWeight: 444.9775

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)CCC3=CC=CC=C3Cl

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)CCC3=CC=CC=C3Cl

InChI

InChI=1S/C22H25ClN4O2S/c1-26-12-14-27(15-13-26)21(29)17-7-3-5-9-19(17)24-22(30)25-20(28)11-10-16-6-2-4-8-18(16)23/h2-9H,10-15H2,1H3,(H2,24,25,28,30)