3-(2-chlorophenyl)-N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]propanamide

Systemtic Name: 3-(2-chlorophenyl)-N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]propanamide Openeye Name: 3-(2-chlorophenyl)-N-[[4-(1-piperidylsulfonyl)phenyl]carbamothioyl]propanamide CAS Name: 3-(2-chlorophenyl)-N-[[4-(1-piperidinylsulfonyl)anilino]-sulfanylidenemethyl]propanamide IUPAC Name: 3-(2-chlorophenyl)-N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]propanamide Traditional Name: 3-(2-chlorophenyl)-N-[(4-piperidinosulfonylphenyl)thiocarbamoyl]propionamide Formula: C21H24ClN3O3S2 MolecularWeight: 466.01656

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)CCC3=CC=CC=C3Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)CCC3=CC=CC=C3Cl

InChI

InChI=1S/C21H24ClN3O3S2/c22-19-7-3-2-6-16(19)8-13-20(26)24-21(29)23-17-9-11-18(12-10-17)30(27,28)25-14-4-1-5-15-25/h2-3,6-7,9-12H,1,4-5,8,13-15H2,(H2,23,24,26,29)