1-(4-bromophenyl)carbonyl-N-(4-methoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-(4-bromophenyl)carbonyl-N-(4-methoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-(4-bromobenzoyl)-N-(4-methoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)-oxomethyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-(4-bromobenzoyl)-N-(4-methoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-(4-bromobenzoyl)-N-(4-methoxy-1,3-benzothiazol-2-yl)isonipecotamide Formula: C21H20BrN3O3S MolecularWeight: 474.3708

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC=C1)SC(=N2)NC(=O)C3CCN(CC3)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=C2C(=CC=C1)SC(=N2)NC(=O)C3CCN(CC3)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H20BrN3O3S/c1-28-16-3-2-4-17-18(16)23-21(29-17)24-19(26)13-9-11-25(12-10-13)20(27)14-5-7-15(22)8-6-14/h2-8,13H,9-12H2,1H3,(H,23,24,26)