6-[[(4,5-dimethoxy-2-pyrrol-1-yl-phenyl)amino]methyl]-5-methyl-pyrido[2,3-d]pyrimidine-2,4-diamine

Systemtic Name: 6-[[(4,5-dimethoxy-2-pyrrol-1-yl-phenyl)amino]methyl]-5-methyl-pyrido[2,3-d]pyrimidine-2,4-diamine Openeye Name: 6-[(4,5-dimethoxy-2-pyrrol-1-yl-anilino)methyl]-5-methyl-pyrido[2,3-d]pyrimidine-2,4-diamine CAS Name: 6-[[4,5-dimethoxy-2-(1-pyrrolyl)anilino]methyl]-5-methylpyrido[2,3-d]pyrimidine-2,4-diamine IUPAC Name: 6-[(4,5-dimethoxy-2-pyrrol-1-ylanilino)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-(4,5-dimethoxy-2-pyrrol-1-yl-phenyl)amine Formula: C21H23N7O2 MolecularWeight: 405.45302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC(=NC2=NC=C1CNC3=CC(=C(C=C3N4C=CC=C4)OC)OC)N)N

Isomeric SMILES

CC1=C2C(=NC(=NC2=NC=C1CNC3=CC(=C(C=C3N4C=CC=C4)OC)OC)N)N

InChI

InChI=1S/C21H23N7O2/c1-12-13(11-25-20-18(12)19(22)26-21(23)27-20)10-24-14-8-16(29-2)17(30-3)9-15(14)28-6-4-5-7-28/h4-9,11,24H,10H2,1-3H3,(H4,22,23,25,26,27)