3-chloranyl-N-[4-(2,3,4,5,6-pentamethylphenyl)carbonylphenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[4-(2,3,4,5,6-pentamethylphenyl)carbonylphenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[4-(2,3,4,5,6-pentamethylbenzoyl)phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[4-[oxo-(2,3,4,5,6-pentamethylphenyl)methyl]phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[4-(2,3,4,5,6-pentamethylbenzoyl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[4-(2,3,4,5,6-pentamethylbenzoyl)phenyl]benzothiophene-2-carboxamide Formula: C27H24ClNO2S MolecularWeight: 462.00296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)C(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)C(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl)C)C

InChI

InChI=1S/C27H24ClNO2S/c1-14-15(2)17(4)23(18(5)16(14)3)25(30)19-10-12-20(13-11-19)29-27(31)26-24(28)21-8-6-7-9-22(21)32-26/h6-13H,1-5H3,(H,29,31)