4-[(E)-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylideneamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(E)-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylideneamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyleneamino]-3-(4-pyridyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(3,5-dimethyl-1-phenyl-4-pyrazolyl)methylideneamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(3,5-dimethyl-1-phenylpyrazol-4-yl)methylideneamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyleneamino]-3-(4-pyridyl)-1H-1,2,4-triazole-5-thione Formula: C19H17N7S MolecularWeight: 375.45018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=NN3C(=NNC3=S)C4=CC=NC=C4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)/C=N/N3C(=NNC3=S)C4=CC=NC=C4

InChI

InChI=1S/C19H17N7S/c1-13-17(14(2)25(24-13)16-6-4-3-5-7-16)12-21-26-18(22-23-19(26)27)15-8-10-20-11-9-15/h3-12H,1-2H3,(H,23,27)/b21-12+