(3S)-3-[2-(4-bromophenyl)-1H-indol-3-yl]-2-(thiophen-2-ylmethyl)-3H-isoindol-1-one

Systemtic Name: (3S)-3-[2-(4-bromophenyl)-1H-indol-3-yl]-2-(thiophen-2-ylmethyl)-3H-isoindol-1-one Openeye Name: (3S)-3-[2-(4-bromophenyl)-1H-indol-3-yl]-2-(2-thienylmethyl)isoindolin-1-one CAS Name: (3S)-3-[2-(4-bromophenyl)-1H-indol-3-yl]-2-(thiophen-2-ylmethyl)-3H-isoindol-1-one IUPAC Name: (3S)-3-[2-(4-bromophenyl)-1H-indol-3-yl]-2-(thiophen-2-ylmethyl)-3H-isoindol-1-one Traditional Name: (3S)-3-[2-(4-bromophenyl)-1H-indol-3-yl]-2-(2-thenyl)isoindolin-1-one Formula: C27H19BrN2OS MolecularWeight: 499.42156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(N(C2=O)CC3=CC=CS3)C4=C(NC5=CC=CC=C54)C6=CC=C(C=C6)Br

Isomeric SMILES

C1=CC=C2C(=C1)[C@H](N(C2=O)CC3=CC=CS3)C4=C(NC5=CC=CC=C54)C6=CC=C(C=C6)Br

InChI

InChI=1S/C27H19BrN2OS/c28-18-13-11-17(12-14-18)25-24(22-9-3-4-10-23(22)29-25)26-20-7-1-2-8-21(20)27(31)30(26)16-19-6-5-15-32-19/h1-15,26,29H,16H2/t26-/m0/s1