N-[4-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]phenyl]naphthalene-1-sulfonamide

Systemtic Name: N-[4-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]phenyl]naphthalene-1-sulfonamide Openeye Name: N-[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]naphthalene-1-sulfonamide CAS Name: N-[4-[4-[(4-tert-butylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-1-naphthalenesulfonamide IUPAC Name: N-[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]naphthalene-1-sulfonamide Traditional Name: N-[4-[4-(4-tert-butylbenzoyl)piperazino]phenyl]naphthalene-1-sulfonamide Formula: C31H33N3O3S MolecularWeight: 527.67702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C31H33N3O3S/c1-31(2,3)25-13-11-24(12-14-25)30(35)34-21-19-33(20-22-34)27-17-15-26(16-18-27)32-38(36,37)29-10-6-8-23-7-4-5-9-28(23)29/h4-18,32H,19-22H2,1-3H3