1-ethyl-2-isoquinolin-5-ylsulfonyl-1,3,4,9-tetrahydropyrido[3,4-b]indole

Systemtic Name: 1-ethyl-2-isoquinolin-5-ylsulfonyl-1,3,4,9-tetrahydropyrido[3,4-b]indole Openeye Name: 1-ethyl-2-(5-isoquinolylsulfonyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole CAS Name: 1-ethyl-2-(5-isoquinolinylsulfonyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole IUPAC Name: 1-ethyl-2-isoquinolin-5-ylsulfonyl-1,3,4,9-tetrahydropyrido[3,4-b]indole Traditional Name: 1-ethyl-2-(5-isoquinolylsulfonyl)-1,3,4,9-tetrahydro-$b-carboline Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2=C(CCN1S(=O)(=O)C3=CC=CC4=C3C=CN=C4)C5=CC=CC=C5N2

Isomeric SMILES

CCC1C2=C(CCN1S(=O)(=O)C3=CC=CC4=C3C=CN=C4)C5=CC=CC=C5N2

InChI

InChI=1S/C22H21N3O2S/c1-2-20-22-18(17-7-3-4-8-19(17)24-22)11-13-25(20)28(26,27)21-9-5-6-15-14-23-12-10-16(15)21/h3-10,12,14,20,24H,2,11,13H2,1H3