2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-N-(3-chlorophenyl)propanamide

Systemtic Name: 2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-N-(3-chlorophenyl)propanamide Openeye Name: 2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-N-(3-chlorophenyl)propanamide CAS Name: 2-[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]-N-(3-chlorophenyl)propanamide IUPAC Name: 2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-N-(3-chlorophenyl)propanamide Traditional Name: 2-[4-(4-tert-butylphenyl)sulfonylpiperazino]-N-(3-chlorophenyl)propionamide Formula: C23H30ClN3O3S MolecularWeight: 464.0206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C23H30ClN3O3S/c1-17(22(28)25-20-7-5-6-19(24)16-20)26-12-14-27(15-13-26)31(29,30)21-10-8-18(9-11-21)23(2,3)4/h5-11,16-17H,12-15H2,1-4H3,(H,25,28)