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

Systemtic Name: 6,7-dimethoxy-N-[(2S,3R)-1-[(4-methoxyphenyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: 6,7-dimethoxy-N-[(1S,2R)-1-[(4-methoxyphenyl)carbamoyl]-2-methyl-butyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: 6,7-dimethoxy-N-[(2S,3R)-1-(4-methoxyanilino)-3-methyl-1-oxopentan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: 6,7-dimethoxy-N-[(2S,3R)-1-(4-methoxyanilino)-3-methyl-1-oxopentan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: 6,7-dimethoxy-N-[(1S,2R)-1-[(4-methoxyphenyl)carbamoyl]-2-methyl-butyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C25H33N3O5 MolecularWeight: 455.54662

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC=C(C=C1)OC)NC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC

Isomeric SMILES

CC[C@@H](C)[C@@H](C(=O)NC1=CC=C(C=C1)OC)NC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC

InChI

InChI=1S/C25H33N3O5/c1-6-16(2)23(24(29)26-19-7-9-20(31-3)10-8-19)27-25(30)28-12-11-17-13-21(32-4)22(33-5)14-18(17)15-28/h7-10,13-14,16,23H,6,11-12,15H2,1-5H3,(H,26,29)(H,27,30)/t16-,23+/m1/s1