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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(C)C(=O)C2CCCN(C2)C3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

CCC1=CC=C(C=C1)CN(C)C(=O)C2CCCN(C2)C3=NS(=O)(=O)C4=CC=CC=C43

InChI

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