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

Systemtic Name: 2-[4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-1,3-thiazol-2-yl]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]thiazol-2-yl]-N-(p-tolyl)acetamide CAS Name: 2-[4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-2-thiazolyl]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-1,3-thiazol-2-yl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]thiazol-2-yl]-N-(p-tolyl)acetamide Formula: C18H19N5O3S MolecularWeight: 385.44016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CC2=NC(=CS2)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CC2=NC(=CS2)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

InChI

InChI=1S/C18H19N5O3S/c1-11-4-6-14(7-5-11)19-16(24)8-17-20-15(10-27-17)9-22-13(3)18(23(25)26)12(2)21-22/h4-7,10H,8-9H2,1-3H3,(H,19,24)