N-[4-[4-[2-(3-methylphenyl)ethanoyl]piperazin-1-yl]phenyl]butane-1-sulfonamide

Systemtic Name: N-[4-[4-[2-(3-methylphenyl)ethanoyl]piperazin-1-yl]phenyl]butane-1-sulfonamide Openeye Name: N-[4-[4-[2-(m-tolyl)acetyl]piperazin-1-yl]phenyl]butane-1-sulfonamide CAS Name: N-[4-[4-[2-(3-methylphenyl)-1-oxoethyl]-1-piperazinyl]phenyl]-1-butanesulfonamide IUPAC Name: N-[4-[4-[2-(3-methylphenyl)acetyl]piperazin-1-yl]phenyl]butane-1-sulfonamide Traditional Name: N-[4-[4-[2-(m-tolyl)acetyl]piperazino]phenyl]butane-1-sulfonamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)CC3=CC=CC(=C3)C

Isomeric SMILES

CCCCS(=O)(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)CC3=CC=CC(=C3)C

InChI

InChI=1S/C23H31N3O3S/c1-3-4-16-30(28,29)24-21-8-10-22(11-9-21)25-12-14-26(15-13-25)23(27)18-20-7-5-6-19(2)17-20/h5-11,17,24H,3-4,12-16,18H2,1-2H3