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

Systemtic Name: N-cycloheptyl-2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-5-nitro-benzamide Openeye Name: N-cycloheptyl-2-(1-methyltetrazol-5-yl)sulfanyl-5-nitro-benzamide CAS Name: N-cycloheptyl-2-[(1-methyl-5-tetrazolyl)thio]-5-nitrobenzamide IUPAC Name: N-cycloheptyl-2-(1-methyltetrazol-5-yl)sulfanyl-5-nitrobenzamide Traditional Name: N-cycloheptyl-2-[(1-methyltetrazol-5-yl)thio]-5-nitro-benzamide Formula: C16H20N6O3S MolecularWeight: 376.4334

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3CCCCCC3

Isomeric SMILES

CN1C(=NN=N1)SC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3CCCCCC3

InChI

InChI=1S/C16H20N6O3S/c1-21-16(18-19-20-21)26-14-9-8-12(22(24)25)10-13(14)15(23)17-11-6-4-2-3-5-7-11/h8-11H,2-7H2,1H3,(H,17,23)