3-(naphthalen-1-ylmethyl)-4-[(E)-(3-nitro-4-pyrimidin-2-ylsulfanyl-phenyl)methylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(naphthalen-1-ylmethyl)-4-[(E)-(3-nitro-4-pyrimidin-2-ylsulfanyl-phenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-(1-naphthylmethyl)-4-[(E)-(3-nitro-4-pyrimidin-2-ylsulfanyl-phenyl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-(1-naphthalenylmethyl)-4-[(E)-[3-nitro-4-(2-pyrimidinylthio)phenyl]methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(naphthalen-1-ylmethyl)-4-[(E)-(3-nitro-4-pyrimidin-2-ylsulfanylphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-(1-naphthylmethyl)-4-[(E)-[3-nitro-4-(2-pyrimidylthio)benzylidene]amino]-1H-1,2,4-triazole-5-thione Formula: C24H17N7O2S2 MolecularWeight: 499.56748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CC3=NNC(=S)N3N=CC4=CC(=C(C=C4)SC5=NC=CC=N5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CC3=NNC(=S)N3/N=C/C4=CC(=C(C=C4)SC5=NC=CC=N5)[N+](=O)[O-]

InChI

InChI=1S/C24H17N7O2S2/c32-31(33)20-13-16(9-10-21(20)35-23-25-11-4-12-26-23)15-27-30-22(28-29-24(30)34)14-18-7-3-6-17-5-1-2-8-19(17)18/h1-13,15H,14H2,(H,29,34)/b27-15+