5-azanylidene-2-(3-nitrophenyl)-4-phenyl-3-sulfanylidene-1,2,4-triazine-6-carbothioamide

Systemtic Name: 5-azanylidene-2-(3-nitrophenyl)-4-phenyl-3-sulfanylidene-1,2,4-triazine-6-carbothioamide Openeye Name: 5-imino-2-(3-nitrophenyl)-4-phenyl-3-thioxo-1,2,4-triazine-6-carbothioamide CAS Name: 5-imino-2-(3-nitrophenyl)-4-phenyl-3-sulfanylidene-1,2,4-triazine-6-carbothioamide IUPAC Name: 5-imino-2-(3-nitrophenyl)-4-phenyl-3-sulfanylidene-1,2,4-triazine-6-carbothioamide Traditional Name: 5-imino-2-(3-nitrophenyl)-4-phenyl-3-thioxo-1,2,4-triazine-6-carbothioamide Formula: C16H12N6O2S2 MolecularWeight: 384.43548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=N)C(=NN(C2=S)C3=CC(=CC=C3)[N+](=O)[O-])C(=S)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=N)C(=NN(C2=S)C3=CC(=CC=C3)[N+](=O)[O-])C(=S)N

InChI

InChI=1S/C16H12N6O2S2/c17-14-13(15(18)25)19-21(11-7-4-8-12(9-11)22(23)24)16(26)20(14)10-5-2-1-3-6-10/h1-9,17H,(H2,18,25)