N-[2-[3-(1,3-dithian-2-yl)-2-(3-oxidanylprop-1-ynyl)indol-1-yl]ethyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[2-[3-(1,3-dithian-2-yl)-2-(3-oxidanylprop-1-ynyl)indol-1-yl]ethyl]-4-methyl-benzenesulfonamide Openeye Name: N-[2-[3-(1,3-dithian-2-yl)-2-(3-hydroxyprop-1-ynyl)indol-1-yl]ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[2-[3-(1,3-dithian-2-yl)-2-(3-hydroxyprop-1-ynyl)-1-indolyl]ethyl]-4-methylbenzenesulfonamide IUPAC Name: N-[2-[3-(1,3-dithian-2-yl)-2-(3-hydroxyprop-1-ynyl)indol-1-yl]ethyl]-4-methylbenzenesulfonamide Traditional Name: N-[2-[3-(1,3-dithian-2-yl)-2-(3-hydroxyprop-1-ynyl)indol-1-yl]ethyl]-4-methyl-benzenesulfonamide Formula: C24H26N2O3S3 MolecularWeight: 486.66984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCN2C3=CC=CC=C3C(=C2C#CCO)C4SCCCS4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCN2C3=CC=CC=C3C(=C2C#CCO)C4SCCCS4

InChI

InChI=1S/C24H26N2O3S3/c1-18-9-11-19(12-10-18)32(28,29)25-13-14-26-21-7-3-2-6-20(21)23(22(26)8-4-15-27)24-30-16-5-17-31-24/h2-3,6-7,9-12,24-25,27H,5,13-17H2,1H3