[2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methyl 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoate

Systemtic Name: [2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methyl 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoate Openeye Name: [2-(4-isopropylphenyl)thiazol-4-yl]methyl 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetate CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)acetic acid [2-(4-propan-2-ylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methyl 2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetate Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetic acid (2-p-cumenylthiazol-4-yl)methyl ester Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)OCC2=CSC(=N2)C3=CC=C(C=C3)C(C)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)OCC2=CSC(=N2)C3=CC=C(C=C3)C(C)C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O4S/c1-12(2)15-5-7-16(8-6-15)20-21-17(11-29-20)10-28-18(25)9-23-14(4)19(24(26)27)13(3)22-23/h5-8,11-12H,9-10H2,1-4H3