N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-2-propyl-pentanamide

Systemtic Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-2-propyl-pentanamide Openeye Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-2-propyl-pentanamide CAS Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-2-propylpentanamide IUPAC Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-2-propylpentanamide Traditional Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-2-propyl-valeramide Formula: C22H36N2O5S MolecularWeight: 440.59664

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)NCCCS(=O)(=O)N1CCC2=CC(=C(C=C2C1)OC)OC

Isomeric SMILES

CCCC(CCC)C(=O)NCCCS(=O)(=O)N1CCC2=CC(=C(C=C2C1)OC)OC

InChI

InChI=1S/C22H36N2O5S/c1-5-8-17(9-6-2)22(25)23-11-7-13-30(26,27)24-12-10-18-14-20(28-3)21(29-4)15-19(18)16-24/h14-15,17H,5-13,16H2,1-4H3,(H,23,25)