3-(2-diethylaminoethyl)-4-phenyl-4-(trichloromethyl)-1H-pyrido[3,4-d]pyrimidin-2-one

Systemtic Name: 3-(2-diethylaminoethyl)-4-phenyl-4-(trichloromethyl)-1H-pyrido[3,4-d]pyrimidin-2-one Openeye Name: 3-(2-diethylaminoethyl)-4-phenyl-4-(trichloromethyl)-1H-pyrido[3,4-d]pyrimidin-2-one CAS Name: 3-(2-diethylaminoethyl)-4-phenyl-4-(trichloromethyl)-1H-pyrido[3,4-d]pyrimidin-2-one IUPAC Name: 3-(2-diethylaminoethyl)-4-phenyl-4-(trichloromethyl)-1H-pyrido[3,4-d]pyrimidin-2-one Traditional Name: 3-(2-diethylaminoethyl)-4-phenyl-4-(trichloromethyl)-1H-pyrido[3,4-d]pyrimidin-2-one Formula: C20H23Cl3N4O MolecularWeight: 441.78182

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C(=O)NC2=C(C1(C3=CC=CC=C3)C(Cl)(Cl)Cl)C=CN=C2

Isomeric SMILES

CCN(CC)CCN1C(=O)NC2=C(C1(C3=CC=CC=C3)C(Cl)(Cl)Cl)C=CN=C2

InChI

InChI=1S/C20H23Cl3N4O/c1-3-26(4-2)12-13-27-18(28)25-17-14-24-11-10-16(17)19(27,20(21,22)23)15-8-6-5-7-9-15/h5-11,14H,3-4,12-13H2,1-2H3,(H,25,28)