4-(3-chloranyl-2-methyl-phenyl)-5-propan-2-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(3-chloranyl-2-methyl-phenyl)-5-propan-2-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-(3-chloro-2-methyl-phenyl)-5-isopropyl-1,2,4-triazole-3-thiolate CAS Name: 4-(3-chloro-2-methylphenyl)-5-propan-2-yl-1,2,4-triazole-3-thiolate IUPAC Name: 4-(3-chloro-2-methylphenyl)-5-propan-2-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-(3-chloro-2-methyl-phenyl)-5-isopropyl-1,2,4-triazole-3-thiolate Formula: C12H13ClN3S- MolecularWeight: 266.76972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2C(=NN=C2[S-])C(C)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2C(=NN=C2[S-])C(C)C

InChI

InChI=1S/C12H14ClN3S/c1-7(2)11-14-15-12(17)16(11)10-6-4-5-9(13)8(10)3/h4-7H,1-3H3,(H,15,17)/p-1