7-[3-(phenylmethyl)indol-1-yl]sulfonyl-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 7-[3-(phenylmethyl)indol-1-yl]sulfonyl-1,2,3,4-tetrahydroisoquinoline Openeye Name: 7-(3-benzylindol-1-yl)sulfonyl-1,2,3,4-tetrahydroisoquinoline CAS Name: 7-[[3-(phenylmethyl)-1-indolyl]sulfonyl]-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 7-(3-benzylindol-1-yl)sulfonyl-1,2,3,4-tetrahydroisoquinoline Traditional Name: 7-(3-benzylindol-1-yl)sulfonyl-1,2,3,4-tetrahydroisoquinoline Formula: C24H22N2O2S MolecularWeight: 402.50868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCC2=C1C=CC(=C2)S(=O)(=O)N3C=C(C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

C1CNCC2=C1C=CC(=C2)S(=O)(=O)N3C=C(C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C24H22N2O2S/c27-29(28,22-11-10-19-12-13-25-16-20(19)15-22)26-17-21(14-18-6-2-1-3-7-18)23-8-4-5-9-24(23)26/h1-11,15,17,25H,12-14,16H2