N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide

Systemtic Name: N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C12H13ClN4O2S MolecularWeight: 312.77522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)CSC2=NC=NN2

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)CSC2=NC=NN2

InChI

InChI=1S/C12H13ClN4O2S/c1-7-3-9(10(19-2)4-8(7)13)16-11(18)5-20-12-14-6-15-17-12/h3-4,6H,5H2,1-2H3,(H,16,18)(H,14,15,17)