4-(cyclopentylamino)-2-[[4-(hydroxymethyl)-5-pyrrolidin-1-yl-pyridin-2-yl]amino]pyrimidine-5-carbonitrile

Systemtic Name: 4-(cyclopentylamino)-2-[[4-(hydroxymethyl)-5-pyrrolidin-1-yl-pyridin-2-yl]amino]pyrimidine-5-carbonitrile Openeye Name: 4-(cyclopentylamino)-2-[[4-(hydroxymethyl)-5-pyrrolidin-1-yl-2-pyridyl]amino]pyrimidine-5-carbonitrile CAS Name: 4-(cyclopentylamino)-2-[[4-(hydroxymethyl)-5-(1-pyrrolidinyl)-2-pyridinyl]amino]-5-pyrimidinecarbonitrile IUPAC Name: 4-(cyclopentylamino)-2-[[4-(hydroxymethyl)-5-pyrrolidin-1-ylpyridin-2-yl]amino]pyrimidine-5-carbonitrile Traditional Name: 4-(cyclopentylamino)-2-[(4-methylol-5-pyrrolidino-2-pyridyl)amino]pyrimidine-5-carbonitrile Formula: C20H25N7O MolecularWeight: 379.4588

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=NC(=NC=C2C#N)NC3=NC=C(C(=C3)CO)N4CCCC4

Isomeric SMILES

C1CCC(C1)NC2=NC(=NC=C2C#N)NC3=NC=C(C(=C3)CO)N4CCCC4

InChI

InChI=1S/C20H25N7O/c21-10-15-11-23-20(26-19(15)24-16-5-1-2-6-16)25-18-9-14(13-28)17(12-22-18)27-7-3-4-8-27/h9,11-12,16,28H,1-8,13H2,(H2,22,23,24,25,26)