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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)SC2=NN=NN2C3CC3

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)SC2=NN=NN2C3CC3

InChI

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