2-[2-[(4,6-dimethoxypyrimidin-2-yl)amino]-2-oxidanylidene-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-[2-[(4,6-dimethoxypyrimidin-2-yl)amino]-2-oxidanylidene-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-[2-[(4,6-dimethoxypyrimidin-2-yl)amino]-2-oxo-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[2-[(4,6-dimethoxy-2-pyrimidinyl)amino]-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-[2-[(4,6-dimethoxypyrimidin-2-yl)amino]-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-[2-[(4,6-dimethoxypyrimidin-2-yl)amino]-2-keto-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C18H21N5O4 MolecularWeight: 371.39044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=O)CN2CC3=CC=CC=C3CC2C(=O)N)OC

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=O)CN2CC3=CC=CC=C3CC2C(=O)N)OC

InChI

InChI=1S/C18H21N5O4/c1-26-15-8-16(27-2)22-18(21-15)20-14(24)10-23-9-12-6-4-3-5-11(12)7-13(23)17(19)25/h3-6,8,13H,7,9-10H2,1-2H3,(H2,19,25)(H,20,21,22,24)