N-(2-chlorophenyl)-3-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-(2-chlorophenyl)-3-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]propanamide Openeye Name: N-(2-chlorophenyl)-3-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]propanamide CAS Name: N-(2-chlorophenyl)-3-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]propanamide IUPAC Name: N-(2-chlorophenyl)-3-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]propanamide Traditional Name: N-(2-chlorophenyl)-3-[4-(2,4-dimethylphenyl)sulfonylpiperazino]propionamide Formula: C21H26ClN3O3S MolecularWeight: 435.96744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CCC(=O)NC3=CC=CC=C3Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CCC(=O)NC3=CC=CC=C3Cl)C

InChI

InChI=1S/C21H26ClN3O3S/c1-16-7-8-20(17(2)15-16)29(27,28)25-13-11-24(12-14-25)10-9-21(26)23-19-6-4-3-5-18(19)22/h3-8,15H,9-14H2,1-2H3,(H,23,26)