N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]hexanamide

Systemtic Name: N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]hexanamide Openeye Name: N-[[4-(1-piperidylsulfonyl)phenyl]carbamothioyl]hexanamide CAS Name: N-[[4-(1-piperidinylsulfonyl)anilino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]hexanamide Traditional Name: N-[(4-piperidinosulfonylphenyl)thiocarbamoyl]hexanamide Formula: C18H27N3O3S2 MolecularWeight: 397.55528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O3S2/c1-2-3-5-8-17(22)20-18(25)19-15-9-11-16(12-10-15)26(23,24)21-13-6-4-7-14-21/h9-12H,2-8,13-14H2,1H3,(H2,19,20,22,25)