methyl 3-[(3-chloranyl-4-phenyl-phenyl)methyl]-2-methyl-1-benzothiophene-5-carboxylate

Systemtic Name: methyl 3-[(3-chloranyl-4-phenyl-phenyl)methyl]-2-methyl-1-benzothiophene-5-carboxylate Openeye Name: methyl 3-[(3-chloro-4-phenyl-phenyl)methyl]-2-methyl-benzothiophene-5-carboxylate CAS Name: 3-[(3-chloro-4-phenylphenyl)methyl]-2-methyl-1-benzothiophene-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[(3-chloro-4-phenylphenyl)methyl]-2-methyl-1-benzothiophene-5-carboxylate Traditional Name: 3-(3-chloro-4-phenyl-benzyl)-2-methyl-benzothiophene-5-carboxylic acid methyl ester Formula: C24H19ClO2S MolecularWeight: 406.92446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)C=CC(=C2)C(=O)OC)CC3=CC(=C(C=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C2=C(S1)C=CC(=C2)C(=O)OC)CC3=CC(=C(C=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C24H19ClO2S/c1-15-20(21-14-18(24(26)27-2)9-11-23(21)28-15)12-16-8-10-19(22(25)13-16)17-6-4-3-5-7-17/h3-11,13-14H,12H2,1-2H3