methyl 2-[6,7-dimethoxy-2-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate

Systemtic Name: methyl 2-[6,7-dimethoxy-2-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate Openeye Name: methyl 2-[6,7-dimethoxy-2-[(2-pyrimidin-2-ylthiazol-4-yl)methyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetate CAS Name: 2-[6,7-dimethoxy-2-[[2-(2-pyrimidinyl)-4-thiazolyl]methyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6,7-dimethoxy-2-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetate Traditional Name: 2-[6,7-dimethoxy-2-[[2-(2-pyrimidyl)thiazol-4-yl]methyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)CC3=CSC(=N3)C4=NC=CC=N4)CC(=O)OC)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)CC3=CSC(=N3)C4=NC=CC=N4)CC(=O)OC)OC

InChI

InChI=1S/C22H24N4O4S/c1-28-18-9-14-5-8-26(17(11-20(27)30-3)16(14)10-19(18)29-2)12-15-13-31-22(25-15)21-23-6-4-7-24-21/h4,6-7,9-10,13,17H,5,8,11-12H2,1-3H3