2-[(3,4-dimethoxyphenyl)methyl]-3-phenylsulfanyl-1-(phenylsulfonyl)indole

Systemtic Name: 2-[(3,4-dimethoxyphenyl)methyl]-3-phenylsulfanyl-1-(phenylsulfonyl)indole Openeye Name: 1-(benzenesulfonyl)-2-[(3,4-dimethoxyphenyl)methyl]-3-phenylsulfanyl-indole CAS Name: 1-(benzenesulfonyl)-2-[(3,4-dimethoxyphenyl)methyl]-3-(phenylthio)indole IUPAC Name: 1-(benzenesulfonyl)-2-[(3,4-dimethoxyphenyl)methyl]-3-phenylsulfanylindole Traditional Name: 1-besyl-3-(phenylthio)-2-veratryl-indole Formula: C29H25NO4S2 MolecularWeight: 515.6431

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=C(C3=CC=CC=C3N2S(=O)(=O)C4=CC=CC=C4)SC5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=C(C3=CC=CC=C3N2S(=O)(=O)C4=CC=CC=C4)SC5=CC=CC=C5)OC

InChI

InChI=1S/C29H25NO4S2/c1-33-27-18-17-21(20-28(27)34-2)19-26-29(35-22-11-5-3-6-12-22)24-15-9-10-16-25(24)30(26)36(31,32)23-13-7-4-8-14-23/h3-18,20H,19H2,1-2H3