N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-(5-methyl-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-(5-methyl-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-(4,5-dimethylthiazol-2-yl)-3-(5-methyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-(4,5-dimethyl-2-thiazolyl)-3-(5-methyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-(5-methyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-(4,5-dimethylthiazol-2-yl)-3-(5-methyl-4-nitro-pyrazol-1-yl)propionamide Formula: C12H15N5O3S MolecularWeight: 309.3442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CCN2C(=C(C=N2)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CCN2C(=C(C=N2)[N+](=O)[O-])C)C

InChI

InChI=1S/C12H15N5O3S/c1-7-9(3)21-12(14-7)15-11(18)4-5-16-8(2)10(6-13-16)17(19)20/h6H,4-5H2,1-3H3,(H,14,15,18)