4-[(Z)-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[(Z)-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-[(Z)-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]methyleneamino]-5-(2-thienyl)-1,2,4-triazole-3-thiolate CAS Name: 4-[(Z)-[3-(4-methylphenyl)-1-phenyl-4-pyrazolyl]methylideneamino]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate IUPAC Name: 4-[(Z)-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]methylideneamino]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-[(Z)-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]methyleneamino]-5-(2-thienyl)-1,2,4-triazole-3-thiolate Formula: C23H17N6S2- MolecularWeight: 441.55128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C=NN3C(=NN=C3[S-])C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2/C=N\N3C(=NN=C3[S-])C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C23H18N6S2/c1-16-9-11-17(12-10-16)21-18(15-28(27-21)19-6-3-2-4-7-19)14-24-29-22(25-26-23(29)30)20-8-5-13-31-20/h2-15H,1H3,(H,26,30)/p-1/b24-14-