4-[(4-chloranylpyrazol-1-yl)methyl]-N-(4-methyl-2-nitro-phenyl)thiophene-2-carboxamide

Systemtic Name: 4-[(4-chloranylpyrazol-1-yl)methyl]-N-(4-methyl-2-nitro-phenyl)thiophene-2-carboxamide Openeye Name: 4-[(4-chloropyrazol-1-yl)methyl]-N-(4-methyl-2-nitro-phenyl)thiophene-2-carboxamide CAS Name: 4-[(4-chloro-1-pyrazolyl)methyl]-N-(4-methyl-2-nitrophenyl)-2-thiophenecarboxamide IUPAC Name: 4-[(4-chloropyrazol-1-yl)methyl]-N-(4-methyl-2-nitrophenyl)thiophene-2-carboxamide Traditional Name: 4-[(4-chloropyrazol-1-yl)methyl]-N-(4-methyl-2-nitro-phenyl)thiophene-2-carboxamide Formula: C16H13ClN4O3S MolecularWeight: 376.81742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CC(=CS2)CN3C=C(C=N3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CC(=CS2)CN3C=C(C=N3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H13ClN4O3S/c1-10-2-3-13(14(4-10)21(23)24)19-16(22)15-5-11(9-25-15)7-20-8-12(17)6-18-20/h2-6,8-9H,7H2,1H3,(H,19,22)