6-[(isoquinolin-5-ylamino)methyl]-5-methyl-pyrido[2,3-d]pyrimidine-2,4-diamine

Systemtic Name: 6-[(isoquinolin-5-ylamino)methyl]-5-methyl-pyrido[2,3-d]pyrimidine-2,4-diamine Openeye Name: 6-[(5-isoquinolylamino)methyl]-5-methyl-pyrido[2,3-d]pyrimidine-2,4-diamine CAS Name: 6-[(5-isoquinolinylamino)methyl]-5-methylpyrido[2,3-d]pyrimidine-2,4-diamine IUPAC Name: 6-[(isoquinolin-5-ylamino)methyl]-5-methylpyrido[2,3-d]pyrimidine-2,4-diamine Traditional Name: (2,4-diamino-5-methyl-pyrido[2,3-d]pyrimidin-6-yl)methyl-(5-isoquinolyl)amine Formula: C18H17N7 MolecularWeight: 331.37448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC(=NC2=NC=C1CNC3=CC=CC4=C3C=CN=C4)N)N

Isomeric SMILES

CC1=C2C(=NC(=NC2=NC=C1CNC3=CC=CC4=C3C=CN=C4)N)N

InChI

InChI=1S/C18H17N7/c1-10-12(9-23-17-15(10)16(19)24-18(20)25-17)8-22-14-4-2-3-11-7-21-6-5-13(11)14/h2-7,9,22H,8H2,1H3,(H4,19,20,23,24,25)