2-(4-cyanophenyl)sulfonyl-N-[2-[di(propan-2-yl)amino]ethyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide

Systemtic Name: 2-(4-cyanophenyl)sulfonyl-N-[2-[di(propan-2-yl)amino]ethyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide Openeye Name: 2-(4-cyanophenyl)sulfonyl-N-[2-(diisopropylamino)ethyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide CAS Name: 2-(4-cyanophenyl)sulfonyl-N-[2-[di(propan-2-yl)amino]ethyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide IUPAC Name: 2-(4-cyanophenyl)sulfonyl-N-[2-[di(propan-2-yl)amino]ethyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide Traditional Name: 2-(4-cyanophenyl)sulfonyl-N-[2-(diisopropylamino)ethyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide Formula: C31H36N4O4S MolecularWeight: 560.70694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCNC(=O)C1C2=C(CCN1S(=O)(=O)C3=CC=C(C=C3)C#N)C=C(C=C2)OC4=CC=CC=C4)C(C)C

Isomeric SMILES

CC(C)N(CCNC(=O)C1C2=C(CCN1S(=O)(=O)C3=CC=C(C=C3)C#N)C=C(C=C2)OC4=CC=CC=C4)C(C)C

InChI

InChI=1S/C31H36N4O4S/c1-22(2)34(23(3)4)19-17-33-31(36)30-29-15-12-27(39-26-8-6-5-7-9-26)20-25(29)16-18-35(30)40(37,38)28-13-10-24(21-32)11-14-28/h5-15,20,22-23,30H,16-19H2,1-4H3,(H,33,36)