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

Systemtic Name: 4-[(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)methylideneamino]-3-(furan-2-yl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]-3-(2-furyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(1-butyl-5-chloro-3-methyl-4-pyrazolyl)methylideneamino]-3-(2-furanyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(1-butyl-5-chloro-3-methylpyrazol-4-yl)methylideneamino]-3-(furan-2-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]-3-(2-furyl)-1H-1,2,4-triazole-5-thione Formula: C15H17ClN6OS MolecularWeight: 364.85308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C=NN2C(=NNC2=S)C3=CC=CO3)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)C=NN2C(=NNC2=S)C3=CC=CO3)Cl

InChI

InChI=1S/C15H17ClN6OS/c1-3-4-7-21-13(16)11(10(2)20-21)9-17-22-14(18-19-15(22)24)12-6-5-8-23-12/h5-6,8-9H,3-4,7H2,1-2H3,(H,19,24)