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

Systemtic Name: N-[2-[di(propan-2-yl)amino]ethyl]-2-(2-methylsulfonylphenyl)carbonyl-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide Openeye Name: N-[2-(diisopropylamino)ethyl]-2-(2-methylsulfonylbenzoyl)-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide CAS Name: N-[2-[di(propan-2-yl)amino]ethyl]-2-[(2-methylsulfonylphenyl)-oxomethyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide IUPAC Name: N-[2-[di(propan-2-yl)amino]ethyl]-2-(2-methylsulfonylbenzoyl)-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide Traditional Name: N-[2-(diisopropylamino)ethyl]-2-(2-mesylbenzoyl)-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide Formula: C32H39N3O5S MolecularWeight: 577.73416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCNC(=O)C1C2=C(CCN1C(=O)C3=CC=CC=C3S(=O)(=O)C)C=C(C=C2)OC4=CC=CC=C4)C(C)C

Isomeric SMILES

CC(C)N(CCNC(=O)C1C2=C(CCN1C(=O)C3=CC=CC=C3S(=O)(=O)C)C=C(C=C2)OC4=CC=CC=C4)C(C)C

InChI

InChI=1S/C32H39N3O5S/c1-22(2)34(23(3)4)20-18-33-31(36)30-27-16-15-26(40-25-11-7-6-8-12-25)21-24(27)17-19-35(30)32(37)28-13-9-10-14-29(28)41(5,38)39/h6-16,21-23,30H,17-20H2,1-5H3,(H,33,36)