4-azanyl-2-[(2,6-dimethylphenyl)amino]-N-(3-fluorophenyl)-5-(phenylcarbonyl)thiophene-3-carboxamide

Systemtic Name: 4-azanyl-2-[(2,6-dimethylphenyl)amino]-N-(3-fluorophenyl)-5-(phenylcarbonyl)thiophene-3-carboxamide Openeye Name: 4-amino-5-benzoyl-2-(2,6-dimethylanilino)-N-(3-fluorophenyl)thiophene-3-carboxamide CAS Name: 4-amino-5-benzoyl-2-(2,6-dimethylanilino)-N-(3-fluorophenyl)-3-thiophenecarboxamide IUPAC Name: 4-amino-5-benzoyl-2-(2,6-dimethylanilino)-N-(3-fluorophenyl)thiophene-3-carboxamide Traditional Name: 4-amino-5-benzoyl-2-(2,6-dimethylanilino)-N-(3-fluorophenyl)thiophene-3-carboxamide Formula: C26H22FN3O2S MolecularWeight: 459.535183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC2=C(C(=C(S2)C(=O)C3=CC=CC=C3)N)C(=O)NC4=CC(=CC=C4)F

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC2=C(C(=C(S2)C(=O)C3=CC=CC=C3)N)C(=O)NC4=CC(=CC=C4)F

InChI

InChI=1S/C26H22FN3O2S/c1-15-8-6-9-16(2)22(15)30-26-20(25(32)29-19-13-7-12-18(27)14-19)21(28)24(33-26)23(31)17-10-4-3-5-11-17/h3-14,30H,28H2,1-2H3,(H,29,32)