N-[3-(3,5-dimethylpyrazol-1-yl)phenyl]-5-methyl-4-nitro-thiophene-2-carboxamide

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)phenyl]-5-methyl-4-nitro-thiophene-2-carboxamide Openeye Name: N-[3-(3,5-dimethylpyrazol-1-yl)phenyl]-5-methyl-4-nitro-thiophene-2-carboxamide CAS Name: N-[3-(3,5-dimethyl-1-pyrazolyl)phenyl]-5-methyl-4-nitro-2-thiophenecarboxamide IUPAC Name: N-[3-(3,5-dimethylpyrazol-1-yl)phenyl]-5-methyl-4-nitrothiophene-2-carboxamide Traditional Name: N-[3-(3,5-dimethylpyrazol-1-yl)phenyl]-5-methyl-4-nitro-thiophene-2-carboxamide Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC(=CC=C2)NC(=O)C3=CC(=C(S3)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1C2=CC(=CC=C2)NC(=O)C3=CC(=C(S3)C)[N+](=O)[O-])C

InChI

InChI=1S/C17H16N4O3S/c1-10-7-11(2)20(19-10)14-6-4-5-13(8-14)18-17(22)16-9-15(21(23)24)12(3)25-16/h4-9H,1-3H3,(H,18,22)