4-chloranyl-N-[4-(3,4-dimethylphenyl)-5-methyl-1,3-thiazol-2-yl]-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: 4-chloranyl-N-[4-(3,4-dimethylphenyl)-5-methyl-1,3-thiazol-2-yl]-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: 4-chloro-N-[4-(3,4-dimethylphenyl)-5-methyl-thiazol-2-yl]-3-nitro-1H-pyrazole-5-carboxamide CAS Name: 4-chloro-N-[4-(3,4-dimethylphenyl)-5-methyl-2-thiazolyl]-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: 4-chloro-N-[4-(3,4-dimethylphenyl)-5-methyl-1,3-thiazol-2-yl]-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: 4-chloro-N-[4-(3,4-dimethylphenyl)-5-methyl-thiazol-2-yl]-3-nitro-1H-pyrazole-5-carboxamide Formula: C16H14ClN5O3S MolecularWeight: 391.83206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(SC(=N2)NC(=O)C3=C(C(=NN3)[N+](=O)[O-])Cl)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(SC(=N2)NC(=O)C3=C(C(=NN3)[N+](=O)[O-])Cl)C)C

InChI

InChI=1S/C16H14ClN5O3S/c1-7-4-5-10(6-8(7)2)12-9(3)26-16(18-12)19-15(23)13-11(17)14(21-20-13)22(24)25/h4-6H,1-3H3,(H,20,21)(H,18,19,23)