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

Systemtic Name: 4-[[1-(2-ethoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-3-nitro-benzamide Openeye Name: 4-[1-(2-ethoxyphenyl)tetrazol-5-yl]sulfanyl-3-nitro-benzamide CAS Name: 4-[[1-(2-ethoxyphenyl)-5-tetrazolyl]thio]-3-nitrobenzamide IUPAC Name: 4-[1-(2-ethoxyphenyl)tetrazol-5-yl]sulfanyl-3-nitrobenzamide Traditional Name: 3-nitro-4-[(1-o-phenetyltetrazol-5-yl)thio]benzamide Formula: C16H14N6O4S MolecularWeight: 386.38516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=NN=N2)SC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=NN=N2)SC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H14N6O4S/c1-2-26-13-6-4-3-5-11(13)21-16(18-19-20-21)27-14-8-7-10(15(17)23)9-12(14)22(24)25/h3-9H,2H2,1H3,(H2,17,23)