2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(4-ethoxy-2-nitro-phenyl)ethanamide

Systemtic Name: 2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(4-ethoxy-2-nitro-phenyl)ethanamide Openeye Name: 2-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-(4-ethoxy-2-nitro-phenyl)acetamide CAS Name: 2-[(1-cyclopropyl-5-tetrazolyl)thio]-N-(4-ethoxy-2-nitrophenyl)acetamide IUPAC Name: 2-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-(4-ethoxy-2-nitrophenyl)acetamide Traditional Name: 2-[(1-cyclopropyltetrazol-5-yl)thio]-N-(4-ethoxy-2-nitro-phenyl)acetamide Formula: C14H16N6O4S MolecularWeight: 364.37964

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)CSC2=NN=NN2C3CC3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)CSC2=NN=NN2C3CC3)[N+](=O)[O-]

InChI

InChI=1S/C14H16N6O4S/c1-2-24-10-5-6-11(12(7-10)20(22)23)15-13(21)8-25-14-16-17-18-19(14)9-3-4-9/h5-7,9H,2-4,8H2,1H3,(H,15,21)