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

Systemtic Name: 2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chloranyl-4-methoxy-phenyl)ethanamide Openeye Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chloro-4-methoxy-phenyl)acetamide CAS Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-N-(3-chloro-4-methoxyphenyl)acetamide IUPAC Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chloro-4-methoxyphenyl)acetamide Traditional Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-N-(3-chloro-4-methoxy-phenyl)acetamide Formula: C11H12ClN5O2S MolecularWeight: 313.76328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CSC2=NN=CN2N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CSC2=NN=CN2N)Cl

InChI

InChI=1S/C11H12ClN5O2S/c1-19-9-3-2-7(4-8(9)12)15-10(18)5-20-11-16-14-6-17(11)13/h2-4,6H,5,13H2,1H3,(H,15,18)