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

Systemtic Name: N-[2-[di(propan-2-yl)amino]ethyl]-6-phenoxy-2-propan-2-ylsulfonyl-3,4-dihydro-1H-isoquinoline-1-carboxamide Openeye Name: N-[2-(diisopropylamino)ethyl]-2-isopropylsulfonyl-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide CAS Name: N-[2-[di(propan-2-yl)amino]ethyl]-6-phenoxy-2-propan-2-ylsulfonyl-3,4-dihydro-1H-isoquinoline-1-carboxamide IUPAC Name: N-[2-[di(propan-2-yl)amino]ethyl]-6-phenoxy-2-propan-2-ylsulfonyl-3,4-dihydro-1H-isoquinoline-1-carboxamide Traditional Name: N-[2-(diisopropylamino)ethyl]-2-isopropylsulfonyl-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide Formula: C27H39N3O4S MolecularWeight: 501.68126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCNC(=O)C1C2=C(CCN1S(=O)(=O)C(C)C)C=C(C=C2)OC3=CC=CC=C3)C(C)C

Isomeric SMILES

CC(C)N(CCNC(=O)C1C2=C(CCN1S(=O)(=O)C(C)C)C=C(C=C2)OC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C27H39N3O4S/c1-19(2)29(20(3)4)17-15-28-27(31)26-25-13-12-24(34-23-10-8-7-9-11-23)18-22(25)14-16-30(26)35(32,33)21(5)6/h7-13,18-21,26H,14-17H2,1-6H3,(H,28,31)