3-nitro-4-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]benzamide

Systemtic Name: 3-nitro-4-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]benzamide Openeye Name: 3-nitro-4-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]benzamide CAS Name: 3-nitro-4-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]benzamide IUPAC Name: 3-nitro-4-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]benzamide Traditional Name: 3-nitro-4-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]benzamide Formula: C15H11N5O3S MolecularWeight: 341.34454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NN2)SC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NN2)SC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C15H11N5O3S/c16-13(21)10-6-7-12(11(8-10)20(22)23)24-15-17-14(18-19-15)9-4-2-1-3-5-9/h1-8H,(H2,16,21)(H,17,18,19)