1-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyl]-N-(4-methyl-2-oxidanyl-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyl]-N-(4-methyl-2-oxidanyl-phenyl)piperidine-4-carboxamide Openeye Name: 1-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]-N-(2-hydroxy-4-methyl-phenyl)piperidine-4-carboxamide CAS Name: 1-[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]-N-(2-hydroxy-4-methylphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]-N-(2-hydroxy-4-methylphenyl)piperidine-4-carboxamide Traditional Name: 1-[2-(1,3-benzothiazol-2-ylthio)acetyl]-N-(2-hydroxy-4-methyl-phenyl)isonipecotamide Formula: C22H23N3O3S2 MolecularWeight: 441.56632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2CCN(CC2)C(=O)CSC3=NC4=CC=CC=C4S3)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2CCN(CC2)C(=O)CSC3=NC4=CC=CC=C4S3)O

InChI

InChI=1S/C22H23N3O3S2/c1-14-6-7-16(18(26)12-14)23-21(28)15-8-10-25(11-9-15)20(27)13-29-22-24-17-4-2-3-5-19(17)30-22/h2-7,12,15,26H,8-11,13H2,1H3,(H,23,28)