1-(3,5-dimethylphenyl)carbonyl-N-(6-methyl-1,3-benzothiazol-2-yl)piperidine-3-carboxamide

Systemtic Name: 1-(3,5-dimethylphenyl)carbonyl-N-(6-methyl-1,3-benzothiazol-2-yl)piperidine-3-carboxamide Openeye Name: 1-(3,5-dimethylbenzoyl)-N-(6-methyl-1,3-benzothiazol-2-yl)piperidine-3-carboxamide CAS Name: 1-[(3,5-dimethylphenyl)-oxomethyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-3-piperidinecarboxamide IUPAC Name: 1-(3,5-dimethylbenzoyl)-N-(6-methyl-1,3-benzothiazol-2-yl)piperidine-3-carboxamide Traditional Name: 1-(3,5-dimethylbenzoyl)-N-(6-methyl-1,3-benzothiazol-2-yl)nipecotamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCCN(C3)C(=O)C4=CC(=CC(=C4)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCCN(C3)C(=O)C4=CC(=CC(=C4)C)C

InChI

InChI=1S/C23H25N3O2S/c1-14-6-7-19-20(12-14)29-23(24-19)25-21(27)17-5-4-8-26(13-17)22(28)18-10-15(2)9-16(3)11-18/h6-7,9-12,17H,4-5,8,13H2,1-3H3,(H,24,25,27)