3-[[3-(2-hydroxyethyloxymethyl)-2,6-bis(oxidanylidene)-5-propan-2-yl-pyrimidin-4-yl]amino]-5-methyl-benzenecarbonitrile

Systemtic Name: 3-[[3-(2-hydroxyethyloxymethyl)-2,6-bis(oxidanylidene)-5-propan-2-yl-pyrimidin-4-yl]amino]-5-methyl-benzenecarbonitrile Openeye Name: 3-[[3-(2-hydroxyethoxymethyl)-5-isopropyl-2,6-dioxo-pyrimidin-4-yl]amino]-5-methyl-benzonitrile CAS Name: 3-[[3-(2-hydroxyethoxymethyl)-2,6-dioxo-5-propan-2-yl-4-pyrimidinyl]amino]-5-methylbenzonitrile IUPAC Name: 3-[[3-(2-hydroxyethoxymethyl)-2,6-dioxo-5-propan-2-ylpyrimidin-4-yl]amino]-5-methylbenzonitrile Traditional Name: 3-[[3-(2-hydroxyethoxymethyl)-5-isopropyl-2,6-diketo-pyrimidin-4-yl]amino]-5-methyl-benzonitrile Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C#N)NC2=C(C(=O)NC(=O)N2COCCO)C(C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C#N)NC2=C(C(=O)NC(=O)N2COCCO)C(C)C

InChI

InChI=1S/C18H22N4O4/c1-11(2)15-16(20-14-7-12(3)6-13(8-14)9-19)22(10-26-5-4-23)18(25)21-17(15)24/h6-8,11,20,23H,4-5,10H2,1-3H3,(H,21,24,25)