2-[3-(4-methylphenyl)sulfonyl-1-(phenylmethyl)indol-2-yl]sulfanylethanamine

Systemtic Name: 2-[3-(4-methylphenyl)sulfonyl-1-(phenylmethyl)indol-2-yl]sulfanylethanamine Openeye Name: 2-[1-benzyl-3-(p-tolylsulfonyl)indol-2-yl]sulfanylethanamine CAS Name: 2-[[3-(4-methylphenyl)sulfonyl-1-(phenylmethyl)-2-indolyl]thio]ethanamine IUPAC Name: 2-[1-benzyl-3-(4-methylphenyl)sulfonylindol-2-yl]sulfanylethanamine Traditional Name: 2-[(1-benzyl-3-tosyl-indol-2-yl)thio]ethylamine Formula: C24H24N2O2S2 MolecularWeight: 436.58956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=CC=CC=C32)CC4=CC=CC=C4)SCCN

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=CC=CC=C32)CC4=CC=CC=C4)SCCN

InChI

InChI=1S/C24H24N2O2S2/c1-18-11-13-20(14-12-18)30(27,28)23-21-9-5-6-10-22(21)26(24(23)29-16-15-25)17-19-7-3-2-4-8-19/h2-14H,15-17,25H2,1H3