2-[[4-azanyl-5-(3-chloranyl-2-methyl-phenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-pyridin-4-yl-ethanamide

Systemtic Name: 2-[[4-azanyl-5-(3-chloranyl-2-methyl-phenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-pyridin-4-yl-ethanamide Openeye Name: 2-[[4-amino-5-(3-chloro-2-methyl-phenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-pyridyl)acetamide CAS Name: 2-[[4-amino-5-(3-chloro-2-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-pyridin-4-ylacetamide IUPAC Name: 2-[[4-amino-5-(3-chloro-2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-pyridin-4-ylacetamide Traditional Name: 2-[[4-amino-5-(3-chloro-2-methyl-phenyl)-1,2,4-triazol-3-yl]thio]-N-(4-pyridyl)acetamide Formula: C16H15ClN6OS MolecularWeight: 374.8479

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)C2=NN=C(N2N)SCC(=O)NC3=CC=NC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)C2=NN=C(N2N)SCC(=O)NC3=CC=NC=C3

InChI

InChI=1S/C16H15ClN6OS/c1-10-12(3-2-4-13(10)17)15-21-22-16(23(15)18)25-9-14(24)20-11-5-7-19-8-6-11/h2-8H,9,18H2,1H3,(H,19,20,24)