2,2-dimethyl-N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]propanamide

Systemtic Name: 2,2-dimethyl-N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]propanamide Openeye Name: 2,2-dimethyl-N-[[4-(1-piperidylsulfonyl)phenyl]carbamothioyl]propanamide CAS Name: 2,2-dimethyl-N-[[4-(1-piperidinylsulfonyl)anilino]-sulfanylidenemethyl]propanamide IUPAC Name: 2,2-dimethyl-N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]propanamide Traditional Name: 2,2-dimethyl-N-[(4-piperidinosulfonylphenyl)thiocarbamoyl]propionamide Formula: C17H25N3O3S2 MolecularWeight: 383.5287

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CC(C)(C)C(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C17H25N3O3S2/c1-17(2,3)15(21)19-16(24)18-13-7-9-14(10-8-13)25(22,23)20-11-5-4-6-12-20/h7-10H,4-6,11-12H2,1-3H3,(H2,18,19,21,24)