3-cyano-N-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]benzenesulfonamide

Systemtic Name: 3-cyano-N-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]benzenesulfonamide Openeye Name: 3-cyano-N-[4-[[(3S)-3-methyl-1-piperidyl]sulfonyl]phenyl]benzenesulfonamide CAS Name: 3-cyano-N-[4-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]phenyl]benzenesulfonamide IUPAC Name: 3-cyano-N-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]benzenesulfonamide Traditional Name: 3-cyano-N-[4-[(3S)-3-methylpiperidino]sulfonylphenyl]benzenesulfonamide Formula: C19H21N3O4S2 MolecularWeight: 419.51774

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C19H21N3O4S2/c1-15-4-3-11-22(14-15)28(25,26)18-9-7-17(8-10-18)21-27(23,24)19-6-2-5-16(12-19)13-20/h2,5-10,12,15,21H,3-4,11,14H2,1H3/t15-/m0/s1