[2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: [2-(1H-indol-3-yl)-2-oxo-1-phenyl-ethyl] 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid [2-(1H-indol-3-yl)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(1H-indol-3-yl)-2-oxo-1-phenylethyl] 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid [2-(1H-indol-3-yl)-2-keto-1-phenyl-ethyl] ester Formula: C25H16ClNO3S MolecularWeight: 445.91744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)C2=CNC3=CC=CC=C32)OC(=O)C4=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)C2=CNC3=CC=CC=C32)OC(=O)C4=C(C5=CC=CC=C5S4)Cl

InChI

InChI=1S/C25H16ClNO3S/c26-21-17-11-5-7-13-20(17)31-24(21)25(29)30-23(15-8-2-1-3-9-15)22(28)18-14-27-19-12-6-4-10-16(18)19/h1-14,23,27H