4-nitro-N-[2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl]benzamide

Systemtic Name: 4-nitro-N-[2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl]benzamide Openeye Name: 4-nitro-N-[2-(1-phenyltetrazol-5-yl)sulfanylethyl]benzamide CAS Name: 4-nitro-N-[2-[(1-phenyl-5-tetrazolyl)thio]ethyl]benzamide IUPAC Name: 4-nitro-N-[2-(1-phenyltetrazol-5-yl)sulfanylethyl]benzamide Traditional Name: 4-nitro-N-[2-[(1-phenyltetrazol-5-yl)thio]ethyl]benzamide Formula: C16H14N6O3S MolecularWeight: 370.38576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N6O3S/c23-15(12-6-8-14(9-7-12)22(24)25)17-10-11-26-16-18-19-20-21(16)13-4-2-1-3-5-13/h1-9H,10-11H2,(H,17,23)