1-(5-chloranyl-2-methoxy-phenyl)carbonyl-N-(4-methyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)carbonyl-N-(4-methyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-(5-chloro-2-methoxy-benzoyl)-N-(4-methyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-[(5-chloro-2-methoxyphenyl)-oxomethyl]-N-(4-methyl-1,3-benzothiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-(5-chloro-2-methoxybenzoyl)-N-(4-methyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-(5-chloro-2-methoxy-benzoyl)-N-(4-methyl-1,3-benzothiazol-2-yl)isonipecotamide Formula: C22H22ClN3O3S MolecularWeight: 443.94638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3CCN(CC3)C(=O)C4=C(C=CC(=C4)Cl)OC

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3CCN(CC3)C(=O)C4=C(C=CC(=C4)Cl)OC

InChI

InChI=1S/C22H22ClN3O3S/c1-13-4-3-5-18-19(13)24-22(30-18)25-20(27)14-8-10-26(11-9-14)21(28)16-12-15(23)6-7-17(16)29-2/h3-7,12,14H,8-11H2,1-2H3,(H,24,25,27)