N-(2-methoxy-4-nitro-phenyl)-3-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)propanamide

Systemtic Name: N-(2-methoxy-4-nitro-phenyl)-3-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)propanamide Openeye Name: N-(2-methoxy-4-nitro-phenyl)-3-[5-oxo-4-(2-thienyl)tetrazol-1-yl]propanamide CAS Name: N-(2-methoxy-4-nitrophenyl)-3-(5-oxo-4-thiophen-2-yl-1-tetrazolyl)propanamide IUPAC Name: N-(2-methoxy-4-nitrophenyl)-3-(5-oxo-4-thiophen-2-yltetrazol-1-yl)propanamide Traditional Name: 3-[5-keto-4-(2-thienyl)tetrazol-1-yl]-N-(2-methoxy-4-nitro-phenyl)propionamide Formula: C15H14N6O5S MolecularWeight: 390.37386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CCN2C(=O)N(N=N2)C3=CC=CS3

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CCN2C(=O)N(N=N2)C3=CC=CS3

InChI

InChI=1S/C15H14N6O5S/c1-26-12-9-10(21(24)25)4-5-11(12)16-13(22)6-7-19-15(23)20(18-17-19)14-3-2-8-27-14/h2-5,8-9H,6-7H2,1H3,(H,16,22)