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

Systemtic Name: 2-butylsulfonylcarbonyl-N-[2-[di(propan-2-yl)amino]ethyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide Openeye Name: 6-benzyloxy-2-butylsulfonylcarbonyl-N-[2-(diisopropylamino)ethyl]-3,4-dihydro-1H-isoquinoline-1-carboxamide CAS Name: 2-[butylsulfonyl(oxo)methyl]-N-[2-[di(propan-2-yl)amino]ethyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide IUPAC Name: 2-butylsulfonylcarbonyl-N-[2-[di(propan-2-yl)amino]ethyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide Traditional Name: 6-benzoxy-2-butylsulfonylcarbonyl-N-[2-(diisopropylamino)ethyl]-3,4-dihydro-1H-isoquinoline-1-carboxamide Formula: C30H43N3O5S MolecularWeight: 557.74452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C(=O)N1CCC2=C(C1C(=O)NCCN(C(C)C)C(C)C)C=CC(=C2)OCC3=CC=CC=C3

Isomeric SMILES

CCCCS(=O)(=O)C(=O)N1CCC2=C(C1C(=O)NCCN(C(C)C)C(C)C)C=CC(=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C30H43N3O5S/c1-6-7-19-39(36,37)30(35)33-17-15-25-20-26(38-21-24-11-9-8-10-12-24)13-14-27(25)28(33)29(34)31-16-18-32(22(2)3)23(4)5/h8-14,20,22-23,28H,6-7,15-19,21H2,1-5H3,(H,31,34)