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

Systemtic Name: 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-(phenylmethyl)-N-propyl-piperidine-3-carboxamide Openeye Name: N-benzyl-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-propyl-piperidine-3-carboxamide CAS Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(phenylmethyl)-N-propyl-3-piperidinecarboxamide IUPAC Name: N-benzyl-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-propylpiperidine-3-carboxamide Traditional Name: N-benzyl-1-(1,1-diketo-1,2-benzothiazol-3-yl)-N-propyl-nipecotamide Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1)C(=O)C2CCCN(C2)C3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

CCCN(CC1=CC=CC=C1)C(=O)C2CCCN(C2)C3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C23H27N3O3S/c1-2-14-26(16-18-9-4-3-5-10-18)23(27)19-11-8-15-25(17-19)22-20-12-6-7-13-21(20)30(28,29)24-22/h3-7,9-10,12-13,19H,2,8,11,14-17H2,1H3