N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-[4-(2,5-dimethoxyphenyl)thiazol-2-yl]-3-(4-nitropyrazol-1-yl)propanamide CAS Name: N-[4-(2,5-dimethoxyphenyl)-2-thiazolyl]-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-[4-(2,5-dimethoxyphenyl)thiazol-2-yl]-3-(4-nitropyrazol-1-yl)propionamide Formula: C17H17N5O5S MolecularWeight: 403.41238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=CSC(=N2)NC(=O)CCN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=CSC(=N2)NC(=O)CCN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O5S/c1-26-12-3-4-15(27-2)13(7-12)14-10-28-17(19-14)20-16(23)5-6-21-9-11(8-18-21)22(24)25/h3-4,7-10H,5-6H2,1-2H3,(H,19,20,23)