4-[[[2-azanyl-5-cyano-6-(furan-2-yl)pyrimidin-4-yl]amino]methyl]-N-propan-2-yl-benzamide

Systemtic Name: 4-[[[2-azanyl-5-cyano-6-(furan-2-yl)pyrimidin-4-yl]amino]methyl]-N-propan-2-yl-benzamide Openeye Name: 4-[[[2-amino-5-cyano-6-(2-furyl)pyrimidin-4-yl]amino]methyl]-N-isopropyl-benzamide CAS Name: 4-[[[2-amino-5-cyano-6-(2-furanyl)-4-pyrimidinyl]amino]methyl]-N-propan-2-ylbenzamide IUPAC Name: 4-[[[2-amino-5-cyano-6-(furan-2-yl)pyrimidin-4-yl]amino]methyl]-N-propan-2-ylbenzamide Traditional Name: 4-[[[2-amino-5-cyano-6-(2-furyl)pyrimidin-4-yl]amino]methyl]-N-isopropyl-benzamide Formula: C20H20N6O2 MolecularWeight: 376.4118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC=C(C=C1)CNC2=NC(=NC(=C2C#N)C3=CC=CO3)N

Isomeric SMILES

CC(C)NC(=O)C1=CC=C(C=C1)CNC2=NC(=NC(=C2C#N)C3=CC=CO3)N

InChI

InChI=1S/C20H20N6O2/c1-12(2)24-19(27)14-7-5-13(6-8-14)11-23-18-15(10-21)17(25-20(22)26-18)16-4-3-9-28-16/h3-9,12H,11H2,1-2H3,(H,24,27)(H3,22,23,25,26)