4-[(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)methylideneamino]-3-(4-methylphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)methylideneamino]-3-(4-methylphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]-3-(p-tolyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(1-butyl-5-chloro-3-methyl-4-pyrazolyl)methylideneamino]-3-(4-methylphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(1-butyl-5-chloro-3-methylpyrazol-4-yl)methylideneamino]-3-(4-methylphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]-3-(p-tolyl)-1H-1,2,4-triazole-5-thione Formula: C18H21ClN6S MolecularWeight: 388.91754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C=NN2C(=NNC2=S)C3=CC=C(C=C3)C)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)C=NN2C(=NNC2=S)C3=CC=C(C=C3)C)Cl

InChI

InChI=1S/C18H21ClN6S/c1-4-5-10-24-16(19)15(13(3)23-24)11-20-25-17(21-22-18(25)26)14-8-6-12(2)7-9-14/h6-9,11H,4-5,10H2,1-3H3,(H,22,26)