4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)benzamide

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)benzamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[4-methyl-5-(2-pyridyl)thiazol-2-yl]benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-[4-methyl-5-(2-pyridinyl)-2-thiazolyl]benzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)benzamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[4-methyl-5-(2-pyridyl)thiazol-2-yl]benzamide Formula: C22H20N6O3S MolecularWeight: 448.4976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC=C(C=C2)CN3C(=C(C(=N3)C)[N+](=O)[O-])C)C4=CC=CC=N4

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC=C(C=C2)CN3C(=C(C(=N3)C)[N+](=O)[O-])C)C4=CC=CC=N4

InChI

InChI=1S/C22H20N6O3S/c1-13-19(28(30)31)15(3)27(26-13)12-16-7-9-17(10-8-16)21(29)25-22-24-14(2)20(32-22)18-6-4-5-11-23-18/h4-11H,12H2,1-3H3,(H,24,25,29)