3-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-N-phenyl-propane-1-sulfonamide

Systemtic Name: 3-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-N-phenyl-propane-1-sulfonamide Openeye Name: 3-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-oxo-N-phenyl-propane-1-sulfonamide CAS Name: 3-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-3-oxo-N-phenyl-1-propanesulfonamide IUPAC Name: 3-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-oxo-N-phenylpropane-1-sulfonamide Traditional Name: 3-[4-(2,4-dimethylphenyl)sulfonylpiperazino]-3-keto-N-phenyl-propane-1-sulfonamide Formula: C21H27N3O5S2 MolecularWeight: 465.58618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCS(=O)(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCS(=O)(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C21H27N3O5S2/c1-17-8-9-20(18(2)16-17)31(28,29)24-13-11-23(12-14-24)21(25)10-15-30(26,27)22-19-6-4-3-5-7-19/h3-9,16,22H,10-15H2,1-2H3