1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-(4-butylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-(4-butylphenyl)piperidine-4-carboxamide Openeye Name: N-(4-butylphenyl)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)piperidine-4-carboxamide CAS Name: N-(4-butylphenyl)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-4-piperidinecarboxamide IUPAC Name: N-(4-butylphenyl)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)piperidine-4-carboxamide Traditional Name: N-(4-butylphenyl)-1-(1,1-diketo-1,2-benzothiazol-3-yl)isonipecotamide Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C23H27N3O3S/c1-2-3-6-17-9-11-19(12-10-17)24-23(27)18-13-15-26(16-14-18)22-20-7-4-5-8-21(20)30(28,29)25-22/h4-5,7-12,18H,2-3,6,13-16H2,1H3,(H,24,27)