(1S)-1-(1H-indol-3-yl)-2-(phenylmethyl)sulfonyl-1H-isoquinoline

Systemtic Name: (1S)-1-(1H-indol-3-yl)-2-(phenylmethyl)sulfonyl-1H-isoquinoline Openeye Name: (1S)-2-benzylsulfonyl-1-(1H-indol-3-yl)-1H-isoquinoline CAS Name: (1S)-1-(1H-indol-3-yl)-2-(phenylmethyl)sulfonyl-1H-isoquinoline IUPAC Name: (1S)-2-benzylsulfonyl-1-(1H-indol-3-yl)-1H-isoquinoline Traditional Name: (1S)-2-benzylsulfonyl-1-(1H-indol-3-yl)-1H-isoquinoline Formula: C24H20N2O2S MolecularWeight: 400.4928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)N2C=CC3=CC=CC=C3C2C4=CNC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)N2C=CC3=CC=CC=C3[C@H]2C4=CNC5=CC=CC=C54

InChI

InChI=1S/C24H20N2O2S/c27-29(28,17-18-8-2-1-3-9-18)26-15-14-19-10-4-5-11-20(19)24(26)22-16-25-23-13-7-6-12-21(22)23/h1-16,24-25H,17H2/t24-/m0/s1