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

Systemtic Name: 6,7-dimethoxy-N-[(2S)-3-methyl-1-oxidanylidene-1-[(4-propan-2-ylphenyl)amino]butan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-[(1S)-1-[(4-isopropylphenyl)carbamoyl]-2-methyl-propyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: 6,7-dimethoxy-N-[(2S)-3-methyl-1-oxo-1-(4-propan-2-ylanilino)butan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: 6,7-dimethoxy-N-[(2S)-3-methyl-1-oxo-1-(4-propan-2-ylanilino)butan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: 6,7-dimethoxy-N-[(1S)-2-methyl-1-(p-cumenylcarbamoyl)propyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C26H35N3O4 MolecularWeight: 453.5738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H35N3O4/c1-16(2)18-7-9-21(10-8-18)27-25(30)24(17(3)4)28-26(31)29-12-11-19-13-22(32-5)23(33-6)14-20(19)15-29/h7-10,13-14,16-17,24H,11-12,15H2,1-6H3,(H,27,30)(H,28,31)/t24-/m0/s1