4-[(E)-anthracen-9-ylmethylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(E)-anthracen-9-ylmethylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-9-anthrylmethyleneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-9-anthracenylmethylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-anthracen-9-ylmethylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-9-anthrylmethyleneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione Formula: C21H16N6S MolecularWeight: 384.45694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C2=NNC(=S)N2N=CC3=C4C=CC=CC4=CC5=CC=CC=C53

Isomeric SMILES

CC1=CC(=NN1)C2=NNC(=S)N2/N=C/C3=C4C=CC=CC4=CC5=CC=CC=C53

InChI

InChI=1S/C21H16N6S/c1-13-10-19(24-23-13)20-25-26-21(28)27(20)22-12-18-16-8-4-2-6-14(16)11-15-7-3-5-9-17(15)18/h2-12H,1H3,(H,23,24)(H,26,28)/b22-12+