5-methyl-4-nitro-N-[2-(4-pyrazol-1-ylphenyl)ethyl]thiophene-2-carboxamide

Systemtic Name: 5-methyl-4-nitro-N-[2-(4-pyrazol-1-ylphenyl)ethyl]thiophene-2-carboxamide Openeye Name: 5-methyl-4-nitro-N-[2-(4-pyrazol-1-ylphenyl)ethyl]thiophene-2-carboxamide CAS Name: 5-methyl-4-nitro-N-[2-[4-(1-pyrazolyl)phenyl]ethyl]-2-thiophenecarboxamide IUPAC Name: 5-methyl-4-nitro-N-[2-(4-pyrazol-1-ylphenyl)ethyl]thiophene-2-carboxamide Traditional Name: 5-methyl-4-nitro-N-[2-(4-pyrazol-1-ylphenyl)ethyl]thiophene-2-carboxamide Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C(=O)NCCC2=CC=C(C=C2)N3C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(S1)C(=O)NCCC2=CC=C(C=C2)N3C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O3S/c1-12-15(21(23)24)11-16(25-12)17(22)18-9-7-13-3-5-14(6-4-13)20-10-2-8-19-20/h2-6,8,10-11H,7,9H2,1H3,(H,18,22)