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

Systemtic Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(3-methyl-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-(4,5-dimethylthiazol-2-yl)-2-(3-methyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-(4,5-dimethyl-2-thiazolyl)-2-(3-methyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(3-methyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-(4,5-dimethylthiazol-2-yl)-2-(3-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)C(C)N2C=C(C(=N2)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C(C)N2C=C(C(=N2)C)[N+](=O)[O-])C

InChI

InChI=1S/C12H15N5O3S/c1-6-9(4)21-12(13-6)14-11(18)8(3)16-5-10(17(19)20)7(2)15-16/h5,8H,1-4H3,(H,13,14,18)