6-tert-butyl-3-chloranyl-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1-benzothiophene-2-carboxamide

Systemtic Name: 6-tert-butyl-3-chloranyl-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1-benzothiophene-2-carboxamide Openeye Name: 6-tert-butyl-3-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)benzothiophene-2-carboxamide CAS Name: 6-tert-butyl-3-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-1-benzothiophene-2-carboxamide IUPAC Name: 6-tert-butyl-3-chloro-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1-benzothiophene-2-carboxamide Traditional Name: 6-tert-butyl-3-chloro-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)benzothiophene-2-carboxamide Formula: C24H24ClN3O2S MolecularWeight: 453.98426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)C(C)(C)C)Cl

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)C(C)(C)C)Cl

InChI

InChI=1S/C24H24ClN3O2S/c1-14-20(23(30)28(27(14)5)16-9-7-6-8-10-16)26-22(29)21-19(25)17-12-11-15(24(2,3)4)13-18(17)31-21/h6-13H,1-5H3,(H,26,29)