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

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(5-chloranyl-2,4-dimethoxy-phenyl)ethanamide Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(5-chloro-2,4-dimethoxy-phenyl)acetamide CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(5-chloro-2,4-dimethoxyphenyl)acetamide IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(5-chloro-2,4-dimethoxyphenyl)acetamide Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(5-chloro-2,4-dimethoxy-phenyl)acetamide Formula: C12H14ClN5O3S MolecularWeight: 343.78926

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)CSC2=NNC(=N2)N)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)CSC2=NNC(=N2)N)Cl)OC

InChI

InChI=1S/C12H14ClN5O3S/c1-20-8-4-9(21-2)7(3-6(8)13)15-10(19)5-22-12-16-11(14)17-18-12/h3-4H,5H2,1-2H3,(H,15,19)(H3,14,16,17,18)