4-(5-chloranyl-2-methyl-phenyl)-3-[(5-methyl-4-nitroso-2-propan-2-yl-phenoxy)methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(5-chloranyl-2-methyl-phenyl)-3-[(5-methyl-4-nitroso-2-propan-2-yl-phenoxy)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-(5-chloro-2-methyl-phenyl)-3-[(2-isopropyl-5-methyl-4-nitroso-phenoxy)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-(5-chloro-2-methylphenyl)-3-[(5-methyl-4-nitroso-2-propan-2-ylphenoxy)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(5-chloro-2-methylphenyl)-3-[(5-methyl-4-nitroso-2-propan-2-ylphenoxy)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-(5-chloro-2-methyl-phenyl)-3-[(2-isopropyl-5-methyl-4-nitroso-phenoxy)methyl]-1H-1,2,4-triazole-5-thione Formula: C20H21ClN4O2S MolecularWeight: 416.92434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2C(=NNC2=S)COC3=CC(=C(C=C3C(C)C)N=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2C(=NNC2=S)COC3=CC(=C(C=C3C(C)C)N=O)C

InChI

InChI=1S/C20H21ClN4O2S/c1-11(2)15-9-16(24-26)13(4)7-18(15)27-10-19-22-23-20(28)25(19)17-8-14(21)6-5-12(17)3/h5-9,11H,10H2,1-4H3,(H,23,28)