2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3,5-dimethoxyphenyl)ethanamide

Systemtic Name: 2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3,5-dimethoxyphenyl)ethanamide Openeye Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-N-(3,5-dimethoxyphenyl)acetamide CAS Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-N-(3,5-dimethoxyphenyl)acetamide IUPAC Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-N-(3,5-dimethoxyphenyl)acetamide Traditional Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-N-(3,5-dimethoxyphenyl)acetamide Formula: C12H15N5O3S MolecularWeight: 309.3442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CSC2=NN=CN2N)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CSC2=NN=CN2N)OC

InChI

InChI=1S/C12H15N5O3S/c1-19-9-3-8(4-10(5-9)20-2)15-11(18)6-21-12-16-14-7-17(12)13/h3-5,7H,6,13H2,1-2H3,(H,15,18)