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

Systemtic Name: N-[[2-(4-methylpiperazin-1-yl)carbonylphenyl]carbamothioyl]-2-naphthalen-1-yl-ethanamide Openeye Name: N-[[2-(4-methylpiperazine-1-carbonyl)phenyl]carbamothioyl]-2-(1-naphthyl)acetamide CAS Name: N-[[2-[(4-methyl-1-piperazinyl)-oxomethyl]anilino]-sulfanylidenemethyl]-2-(1-naphthalenyl)acetamide IUPAC Name: N-[[2-(4-methylpiperazine-1-carbonyl)phenyl]carbamothioyl]-2-naphthalen-1-ylacetamide Traditional Name: N-[[2-(4-methylpiperazine-1-carbonyl)phenyl]thiocarbamoyl]-2-(1-naphthyl)acetamide Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H26N4O2S/c1-28-13-15-29(16-14-28)24(31)21-11-4-5-12-22(21)26-25(32)27-23(30)17-19-9-6-8-18-7-2-3-10-20(18)19/h2-12H,13-17H2,1H3,(H2,26,27,30,32)