1-(3-nitrophenyl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanone

Systemtic Name: 1-(3-nitrophenyl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanone Openeye Name: 1-(3-nitrophenyl)-2-(1-phenyltetrazol-5-yl)sulfanyl-ethanone CAS Name: 1-(3-nitrophenyl)-2-[(1-phenyl-5-tetrazolyl)thio]ethanone IUPAC Name: 1-(3-nitrophenyl)-2-(1-phenyltetrazol-5-yl)sulfanylethanone Traditional Name: 1-(3-nitrophenyl)-2-[(1-phenyltetrazol-5-yl)thio]ethanone Formula: C15H11N5O3S MolecularWeight: 341.34454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H11N5O3S/c21-14(11-5-4-8-13(9-11)20(22)23)10-24-15-16-17-18-19(15)12-6-2-1-3-7-12/h1-9H,10H2