2-methyl-N-[[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]carbamothioyl]propanamide

Systemtic Name: 2-methyl-N-[[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]carbamothioyl]propanamide Openeye Name: 2-methyl-N-[[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]carbamothioyl]propanamide CAS Name: 2-methyl-N-[[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]anilino]-sulfanylidenemethyl]propanamide IUPAC Name: 2-methyl-N-[[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]carbamothioyl]propanamide Traditional Name: 2-methyl-N-[[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]thiocarbamoyl]propionamide Formula: C16H25N4O3S2+ MolecularWeight: 385.5247

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C

Isomeric SMILES

CC(C)C(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C

InChI

InChI=1S/C16H24N4O3S2/c1-12(2)15(21)18-16(24)17-13-4-6-14(7-5-13)25(22,23)20-10-8-19(3)9-11-20/h4-7,12H,8-11H2,1-3H3,(H2,17,18,21,24)/p+1