3-methyl-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]butanamide

Systemtic Name: 3-methyl-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]butanamide Openeye Name: 3-methyl-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]butanamide CAS Name: 3-methyl-N-[[4-[(4-methyl-1-piperazinyl)sulfonyl]anilino]-sulfanylidenemethyl]butanamide IUPAC Name: 3-methyl-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]butanamide Traditional Name: 3-methyl-N-[[4-(4-methylpiperazino)sulfonylphenyl]thiocarbamoyl]butyramide Formula: C17H26N4O3S2 MolecularWeight: 398.54334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C

Isomeric SMILES

CC(C)CC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C

InChI

InChI=1S/C17H26N4O3S2/c1-13(2)12-16(22)19-17(25)18-14-4-6-15(7-5-14)26(23,24)21-10-8-20(3)9-11-21/h4-7,13H,8-12H2,1-3H3,(H2,18,19,22,25)