N-(5-bromanylpyridin-2-yl)-1-[(4-cyclopropyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperidine-3-carboxamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-1-[(4-cyclopropyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperidine-3-carboxamide Openeye Name: N-(5-bromo-2-pyridyl)-1-[(4-cyclopropyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperidine-3-carboxamide CAS Name: N-(5-bromo-2-pyridinyl)-1-[(4-cyclopropyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-3-piperidinecarboxamide IUPAC Name: N-(5-bromopyridin-2-yl)-1-[(4-cyclopropyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperidine-3-carboxamide Traditional Name: N-(5-bromo-2-pyridyl)-1-[(4-cyclopropyl-5-thioxo-1,2,4-triazol-1-yl)methyl]nipecotamide Formula: C17H21BrN6OS MolecularWeight: 437.35724

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CN2C(=S)N(C=N2)C3CC3)C(=O)NC4=NC=C(C=C4)Br

Isomeric SMILES

C1CC(CN(C1)CN2C(=S)N(C=N2)C3CC3)C(=O)NC4=NC=C(C=C4)Br

InChI

InChI=1S/C17H21BrN6OS/c18-13-3-6-15(19-8-13)21-16(25)12-2-1-7-22(9-12)11-24-17(26)23(10-20-24)14-4-5-14/h3,6,8,10,12,14H,1-2,4-5,7,9,11H2,(H,19,21,25)