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

Systemtic Name: N-[[2-(4-methylpiperazin-1-yl)carbonylphenyl]carbamothioyl]pentanamide Openeye Name: N-[[2-(4-methylpiperazine-1-carbonyl)phenyl]carbamothioyl]pentanamide CAS Name: N-[[2-[(4-methyl-1-piperazinyl)-oxomethyl]anilino]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[[2-(4-methylpiperazine-1-carbonyl)phenyl]carbamothioyl]pentanamide Traditional Name: N-[[2-(4-methylpiperazine-1-carbonyl)phenyl]thiocarbamoyl]valeramide Formula: C18H26N4O2S MolecularWeight: 362.48964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=CC=CC=C1C(=O)N2CCN(CC2)C

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=CC=CC=C1C(=O)N2CCN(CC2)C

InChI

InChI=1S/C18H26N4O2S/c1-3-4-9-16(23)20-18(25)19-15-8-6-5-7-14(15)17(24)22-12-10-21(2)11-13-22/h5-8H,3-4,9-13H2,1-2H3,(H2,19,20,23,25)