N-[3-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]carbonylphenyl]ethanesulfonamide

Systemtic Name: N-[3-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]carbonylphenyl]ethanesulfonamide Openeye Name: N-[3-[4-(4-sec-butylphenyl)sulfonylpiperazine-1-carbonyl]phenyl]ethanesulfonamide CAS Name: N-[3-[[4-(4-butan-2-ylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]phenyl]ethanesulfonamide IUPAC Name: N-[3-[4-(4-butan-2-ylphenyl)sulfonylpiperazine-1-carbonyl]phenyl]ethanesulfonamide Traditional Name: N-[3-[4-(4-sec-butylphenyl)sulfonylpiperazine-1-carbonyl]phenyl]ethanesulfonamide Formula: C23H31N3O5S2 MolecularWeight: 493.63934

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)NS(=O)(=O)CC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)NS(=O)(=O)CC

InChI

InChI=1S/C23H31N3O5S2/c1-4-18(3)19-9-11-22(12-10-19)33(30,31)26-15-13-25(14-16-26)23(27)20-7-6-8-21(17-20)24-32(28,29)5-2/h6-12,17-18,24H,4-5,13-16H2,1-3H3