6,7-dimethoxy-N-[(2S)-1-[(4-methoxyphenyl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: 6,7-dimethoxy-N-[(2S)-1-[(4-methoxyphenyl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: 6,7-dimethoxy-N-[(1S)-1-[(4-methoxyphenyl)methylcarbamoyl]-2-methyl-propyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: 6,7-dimethoxy-N-[(2S)-1-[(4-methoxyphenyl)methylamino]-3-methyl-1-oxobutan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: 6,7-dimethoxy-N-[(2S)-1-[(4-methoxyphenyl)methylamino]-3-methyl-1-oxobutan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: 6,7-dimethoxy-N-[(1S)-2-methyl-1-(p-anisylcarbamoyl)propyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C25H33N3O5 MolecularWeight: 455.54662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC=C(C=C1)OC)NC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CC=C(C=C1)OC)NC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC

InChI

InChI=1S/C25H33N3O5/c1-16(2)23(24(29)26-14-17-6-8-20(31-3)9-7-17)27-25(30)28-11-10-18-12-21(32-4)22(33-5)13-19(18)15-28/h6-9,12-13,16,23H,10-11,14-15H2,1-5H3,(H,26,29)(H,27,30)/t23-/m0/s1