7-(4-chlorophenyl)sulfanyl-4-oct-1-ynyl-1-(phenylsulfonyl)-6,7-dihydro-5H-indol-4-ol

Systemtic Name: 7-(4-chlorophenyl)sulfanyl-4-oct-1-ynyl-1-(phenylsulfonyl)-6,7-dihydro-5H-indol-4-ol Openeye Name: 1-(benzenesulfonyl)-7-(4-chlorophenyl)sulfanyl-4-oct-1-ynyl-6,7-dihydro-5H-indol-4-ol CAS Name: 1-(benzenesulfonyl)-7-[(4-chlorophenyl)thio]-4-oct-1-ynyl-6,7-dihydro-5H-indol-4-ol IUPAC Name: 1-(benzenesulfonyl)-7-(4-chlorophenyl)sulfanyl-4-oct-1-ynyl-6,7-dihydro-5H-indol-4-ol Traditional Name: 1-besyl-7-[(4-chlorophenyl)thio]-4-oct-1-ynyl-6,7-dihydro-5H-indol-4-ol Formula: C28H30ClNO3S2 MolecularWeight: 528.1257

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1(CCC(C2=C1C=CN2S(=O)(=O)C3=CC=CC=C3)SC4=CC=C(C=C4)Cl)O

Isomeric SMILES

CCCCCCC#CC1(CCC(C2=C1C=CN2S(=O)(=O)C3=CC=CC=C3)SC4=CC=C(C=C4)Cl)O

InChI

InChI=1S/C28H30ClNO3S2/c1-2-3-4-5-6-10-19-28(31)20-17-26(34-23-15-13-22(29)14-16-23)27-25(28)18-21-30(27)35(32,33)24-11-8-7-9-12-24/h7-9,11-16,18,21,26,31H,2-6,17,20H2,1H3