5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyrimidin-4-yl]amine Formula: C16H21N5O2 MolecularWeight: 315.37024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CC3=CN=C(N=C3N)N)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CC3=CN=C(N=C3N)N)OC

InChI

InChI=1S/C16H21N5O2/c1-22-13-5-10-3-4-21(8-11(10)6-14(13)23-2)9-12-7-19-16(18)20-15(12)17/h5-7H,3-4,8-9H2,1-2H3,(H4,17,18,19,20)