2-nitro-N-(3-phenyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzamide

Systemtic Name: 2-nitro-N-(3-phenyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzamide Openeye Name: 2-nitro-N-(3-phenyl-5-thioxo-1H-1,2,4-triazol-4-yl)benzamide CAS Name: 2-nitro-N-(3-phenyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzamide IUPAC Name: 2-nitro-N-(3-phenyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzamide Traditional Name: 2-nitro-N-(3-phenyl-5-thioxo-1H-1,2,4-triazol-4-yl)benzamide Formula: C15H11N5O3S MolecularWeight: 341.34454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC(=S)N2NC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC(=S)N2NC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C15H11N5O3S/c21-14(11-8-4-5-9-12(11)20(22)23)18-19-13(16-17-15(19)24)10-6-2-1-3-7-10/h1-9H,(H,17,24)(H,18,21)