4,5-bis(bromanyl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)thiophene-2-carboxamide

Systemtic Name: 4,5-bis(bromanyl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)thiophene-2-carboxamide Openeye Name: 4,5-dibromo-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)thiophene-2-carboxamide CAS Name: 4,5-dibromo-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-thiophenecarboxamide IUPAC Name: 4,5-dibromo-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)thiophene-2-carboxamide Traditional Name: 4,5-dibromo-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)thiophene-2-carboxamide Formula: C16H13Br2N3O2S MolecularWeight: 471.16632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC(=C(S3)Br)Br

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC(=C(S3)Br)Br

InChI

InChI=1S/C16H13Br2N3O2S/c1-9-13(19-15(22)12-8-11(17)14(18)24-12)16(23)21(20(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,19,22)