4-[2-azanyl-5-(3,4-dimethoxyphenyl)pyrimidin-4-yl]-N-(2-pyridin-3-ylethyl)-1H-pyrrole-2-carboxamide

Systemtic Name: 4-[2-azanyl-5-(3,4-dimethoxyphenyl)pyrimidin-4-yl]-N-(2-pyridin-3-ylethyl)-1H-pyrrole-2-carboxamide Openeye Name: 4-[2-amino-5-(3,4-dimethoxyphenyl)pyrimidin-4-yl]-N-[2-(3-pyridyl)ethyl]-1H-pyrrole-2-carboxamide CAS Name: 4-[2-amino-5-(3,4-dimethoxyphenyl)-4-pyrimidinyl]-N-[2-(3-pyridinyl)ethyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-[2-amino-5-(3,4-dimethoxyphenyl)pyrimidin-4-yl]-N-(2-pyridin-3-ylethyl)-1H-pyrrole-2-carboxamide Traditional Name: 4-[2-amino-5-(3,4-dimethoxyphenyl)pyrimidin-4-yl]-N-[2-(3-pyridyl)ethyl]-1H-pyrrole-2-carboxamide Formula: C24H24N6O3 MolecularWeight: 444.48576

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CN=C(N=C2C3=CNC(=C3)C(=O)NCCC4=CN=CC=C4)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CN=C(N=C2C3=CNC(=C3)C(=O)NCCC4=CN=CC=C4)N)OC

InChI

InChI=1S/C24H24N6O3/c1-32-20-6-5-16(11-21(20)33-2)18-14-29-24(25)30-22(18)17-10-19(28-13-17)23(31)27-9-7-15-4-3-8-26-12-15/h3-6,8,10-14,28H,7,9H2,1-2H3,(H,27,31)(H2,25,29,30)