2-[(Z)-2-(1,3-benzodioxol-5-yl)-1-(phenylsulfonyl)ethenyl]-3-phenylsulfanyl-1H-indole

Systemtic Name: 2-[(Z)-2-(1,3-benzodioxol-5-yl)-1-(phenylsulfonyl)ethenyl]-3-phenylsulfanyl-1H-indole Openeye Name: 2-[(Z)-1-(benzenesulfonyl)-2-(1,3-benzodioxol-5-yl)vinyl]-3-phenylsulfanyl-1H-indole CAS Name: 2-[(Z)-1-(benzenesulfonyl)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-(phenylthio)-1H-indole IUPAC Name: 2-[(Z)-1-(benzenesulfonyl)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-phenylsulfanyl-1H-indole Traditional Name: 2-[(Z)-2-(1,3-benzodioxol-5-yl)-1-besyl-vinyl]-3-(phenylthio)-1H-indole Formula: C29H21NO4S2 MolecularWeight: 511.61134

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C(C3=C(C4=CC=CC=C4N3)SC5=CC=CC=C5)S(=O)(=O)C6=CC=CC=C6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C(/C3=C(C4=CC=CC=C4N3)SC5=CC=CC=C5)\S(=O)(=O)C6=CC=CC=C6

InChI

InChI=1S/C29H21NO4S2/c31-36(32,22-11-5-2-6-12-22)27(18-20-15-16-25-26(17-20)34-19-33-25)28-29(35-21-9-3-1-4-10-21)23-13-7-8-14-24(23)30-28/h1-18,30H,19H2/b27-18-