5-bromanyl-3-oxidanyl-3-(2-oxidanylidene-2-thiophen-2-yl-ethyl)-1-(phenylmethyl)indol-2-one

Systemtic Name: 5-bromanyl-3-oxidanyl-3-(2-oxidanylidene-2-thiophen-2-yl-ethyl)-1-(phenylmethyl)indol-2-one Openeye Name: 1-benzyl-5-bromo-3-hydroxy-3-[2-oxo-2-(2-thienyl)ethyl]indolin-2-one CAS Name: 5-bromo-3-hydroxy-3-(2-oxo-2-thiophen-2-ylethyl)-1-(phenylmethyl)-2-indolone IUPAC Name: 1-benzyl-5-bromo-3-hydroxy-3-(2-oxo-2-thiophen-2-ylethyl)indol-2-one Traditional Name: 1-benzyl-5-bromo-3-hydroxy-3-[2-keto-2-(2-thienyl)ethyl]oxindole Formula: C21H16BrNO3S MolecularWeight: 442.32564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Br)C(C2=O)(CC(=O)C4=CC=CS4)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Br)C(C2=O)(CC(=O)C4=CC=CS4)O

InChI

InChI=1S/C21H16BrNO3S/c22-15-8-9-17-16(11-15)21(26,12-18(24)19-7-4-10-27-19)20(25)23(17)13-14-5-2-1-3-6-14/h1-11,26H,12-13H2