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

Systemtic Name: N-(4-fluorophenyl)-4-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-3-nitro-benzamide Openeye Name: N-(4-fluorophenyl)-4-(1-methyltetrazol-5-yl)sulfanyl-3-nitro-benzamide CAS Name: N-(4-fluorophenyl)-4-[(1-methyl-5-tetrazolyl)thio]-3-nitrobenzamide IUPAC Name: N-(4-fluorophenyl)-4-(1-methyltetrazol-5-yl)sulfanyl-3-nitrobenzamide Traditional Name: N-(4-fluorophenyl)-4-[(1-methyltetrazol-5-yl)thio]-3-nitro-benzamide Formula: C15H11FN6O3S MolecularWeight: 374.349643

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SC2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CN1C(=NN=N1)SC2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C15H11FN6O3S/c1-21-15(18-19-20-21)26-13-7-2-9(8-12(13)22(24)25)14(23)17-11-5-3-10(16)4-6-11/h2-8H,1H3,(H,17,23)