1-(4-bromophenyl)carbonyl-N-(5-butyl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-(4-bromophenyl)carbonyl-N-(5-butyl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-(4-bromobenzoyl)-N-(5-butyl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)-oxomethyl]-N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-(4-bromobenzoyl)-N-(5-butyl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-(4-bromobenzoyl)-N-(5-butyl-1,3,4-thiadiazol-2-yl)isonipecotamide Formula: C19H23BrN4O2S MolecularWeight: 451.38052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(S1)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCC1=NN=C(S1)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H23BrN4O2S/c1-2-3-4-16-22-23-19(27-16)21-17(25)13-9-11-24(12-10-13)18(26)14-5-7-15(20)8-6-14/h5-8,13H,2-4,9-12H2,1H3,(H,21,23,25)