ethyl (6R)-4-oxidanylidene-6-phenyl-3-(phenylmethylsulfanyl)-6,7-dihydro-5H-2-benzothiophene-1-carboxylate

Systemtic Name: ethyl (6R)-4-oxidanylidene-6-phenyl-3-(phenylmethylsulfanyl)-6,7-dihydro-5H-2-benzothiophene-1-carboxylate Openeye Name: ethyl (6R)-3-benzylsulfanyl-4-oxo-6-phenyl-6,7-dihydro-5H-2-benzothiophene-1-carboxylate CAS Name: (6R)-4-oxo-6-phenyl-3-(phenylmethylthio)-6,7-dihydro-5H-2-benzothiophene-1-carboxylic acid ethyl ester IUPAC Name: ethyl (6R)-3-benzylsulfanyl-4-oxo-6-phenyl-6,7-dihydro-5H-2-benzothiophene-1-carboxylate Traditional Name: (6R)-3-(benzylthio)-4-keto-6-phenyl-6,7-dihydro-5H-isobenzothiophene-1-carboxylic acid ethyl ester Formula: C24H22O3S2 MolecularWeight: 422.55968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2CC(CC(=O)C2=C(S1)SCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C2C[C@H](CC(=O)C2=C(S1)SCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H22O3S2/c1-2-27-23(26)22-19-13-18(17-11-7-4-8-12-17)14-20(25)21(19)24(29-22)28-15-16-9-5-3-6-10-16/h3-12,18H,2,13-15H2,1H3/t18-/m1/s1