3-chloranyl-N-[2-[(4-ethoxyphenyl)carbamoyl]-4-methyl-phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-[(4-ethoxyphenyl)carbamoyl]-4-methyl-phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-[(4-ethoxyphenyl)carbamoyl]-4-methyl-phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-[(4-ethoxyanilino)-oxomethyl]-4-methylphenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-[(4-ethoxyphenyl)carbamoyl]-4-methylphenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[4-methyl-2-(p-phenetylcarbamoyl)phenyl]benzothiophene-2-carboxamide Formula: C25H21ClN2O3S MolecularWeight: 464.96384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)C)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)C)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C25H21ClN2O3S/c1-3-31-17-11-9-16(10-12-17)27-24(29)19-14-15(2)8-13-20(19)28-25(30)23-22(26)18-6-4-5-7-21(18)32-23/h4-14H,3H2,1-2H3,(H,27,29)(H,28,30)