4-[(Z)-(4-methyl-3-nitro-phenyl)methylideneamino]-3-(phenylmethylsulfanyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(Z)-(4-methyl-3-nitro-phenyl)methylideneamino]-3-(phenylmethylsulfanyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-benzylsulfanyl-4-[(Z)-(4-methyl-3-nitro-phenyl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 4-[(Z)-(4-methyl-3-nitrophenyl)methylideneamino]-3-(phenylmethylthio)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-benzylsulfanyl-4-[(Z)-(4-methyl-3-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-(benzylthio)-4-[(Z)-(4-methyl-3-nitro-benzylidene)amino]-1H-1,2,4-triazole-5-thione Formula: C17H15N5O2S2 MolecularWeight: 385.4633

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C=NN2C(=S)NN=C2SCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)/C=N\N2C(=S)NN=C2SCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N5O2S2/c1-12-7-8-14(9-15(12)22(23)24)10-18-21-16(25)19-20-17(21)26-11-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,19,25)/b18-10-