4-(4-methoxyphenyl)-3-(3-methyl-2-nitro-phenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(4-methoxyphenyl)-3-(3-methyl-2-nitro-phenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(4-methoxyphenyl)-3-(3-methyl-2-nitro-phenyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(4-methoxyphenyl)-3-(3-methyl-2-nitrophenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(4-methoxyphenyl)-3-(3-methyl-2-nitrophenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(4-methoxyphenyl)-3-(3-methyl-2-nitro-phenyl)-1H-1,2,4-triazole-5-thione Formula: C16H14N4O3S MolecularWeight: 342.37236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C2=NNC(=S)N2C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C2=NNC(=S)N2C3=CC=C(C=C3)OC

InChI

InChI=1S/C16H14N4O3S/c1-10-4-3-5-13(14(10)20(21)22)15-17-18-16(24)19(15)11-6-8-12(23-2)9-7-11/h3-9H,1-2H3,(H,18,24)