1-(3-fluorophenyl)carbonyl-N-(6-methyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-(3-fluorophenyl)carbonyl-N-(6-methyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-(3-fluorobenzoyl)-N-(6-methyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-[(3-fluorophenyl)-oxomethyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-(3-fluorobenzoyl)-N-(6-methyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-(3-fluorobenzoyl)-N-(6-methyl-1,3-benzothiazol-2-yl)isonipecotamide Formula: C21H20FN3O2S MolecularWeight: 397.465803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCN(CC3)C(=O)C4=CC(=CC=C4)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCN(CC3)C(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C21H20FN3O2S/c1-13-5-6-17-18(11-13)28-21(23-17)24-19(26)14-7-9-25(10-8-14)20(27)15-3-2-4-16(22)12-15/h2-6,11-12,14H,7-10H2,1H3,(H,23,24,26)