7-(3,4-dihydro-1H-isoquinolin-2-yl)-2,3-dimethyl-1-(phenylmethyl)pyrrolo[2,3-c]pyridine-5-sulfonamide

Systemtic Name: 7-(3,4-dihydro-1H-isoquinolin-2-yl)-2,3-dimethyl-1-(phenylmethyl)pyrrolo[2,3-c]pyridine-5-sulfonamide Openeye Name: 1-benzyl-7-(3,4-dihydro-1H-isoquinolin-2-yl)-2,3-dimethyl-pyrrolo[2,3-c]pyridine-5-sulfonamide CAS Name: 7-(3,4-dihydro-1H-isoquinolin-2-yl)-2,3-dimethyl-1-(phenylmethyl)-5-pyrrolo[2,3-c]pyridinesulfonamide IUPAC Name: 1-benzyl-7-(3,4-dihydro-1H-isoquinolin-2-yl)-2,3-dimethylpyrrolo[2,3-c]pyridine-5-sulfonamide Traditional Name: 1-benzyl-7-(3,4-dihydro-1H-isoquinolin-2-yl)-2,3-dimethyl-pyrrolo[2,3-c]pyridine-5-sulfonamide Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C(N=C(C=C12)S(=O)(=O)N)N3CCC4=CC=CC=C4C3)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(N(C2=C(N=C(C=C12)S(=O)(=O)N)N3CCC4=CC=CC=C4C3)CC5=CC=CC=C5)C

InChI

InChI=1S/C25H26N4O2S/c1-17-18(2)29(15-19-8-4-3-5-9-19)24-22(17)14-23(32(26,30)31)27-25(24)28-13-12-20-10-6-7-11-21(20)16-28/h3-11,14H,12-13,15-16H2,1-2H3,(H2,26,30,31)