1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-[2-(4-methylsulfanylphenyl)ethyl]piperidine-4-carboxamide

Systemtic Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-[2-(4-methylsulfanylphenyl)ethyl]piperidine-4-carboxamide Openeye Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-[2-(4-methylsulfanylphenyl)ethyl]piperidine-4-carboxamide CAS Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-[2-[4-(methylthio)phenyl]ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-[2-(4-methylsulfanylphenyl)ethyl]piperidine-4-carboxamide Traditional Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-[2-[4-(methylthio)phenyl]ethyl]isonipecotamide Formula: C24H29N3OS2 MolecularWeight: 439.63656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N3CCC(CC3)C(=O)NCCC4=CC=C(C=C4)SC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N3CCC(CC3)C(=O)NCCC4=CC=C(C=C4)SC)C

InChI

InChI=1S/C24H29N3OS2/c1-16-14-17(2)22-21(15-16)30-24(26-22)27-12-9-19(10-13-27)23(28)25-11-8-18-4-6-20(29-3)7-5-18/h4-7,14-15,19H,8-13H2,1-3H3,(H,25,28)