2-[4-azanyl-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanyl-1-(2-methylmorpholin-4-yl)ethanone

Systemtic Name: 2-[4-azanyl-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanyl-1-(2-methylmorpholin-4-yl)ethanone Openeye Name: 2-[4-amino-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanyl-1-(2-methylmorpholin-4-yl)ethanone CAS Name: 2-[[4-amino-5-(4-chlorophenyl)-6-ethyl-2-pyrimidinyl]thio]-1-(2-methyl-4-morpholinyl)ethanone IUPAC Name: 2-[4-amino-5-(4-chlorophenyl)-6-ethylpyrimidin-2-yl]sulfanyl-1-(2-methylmorpholin-4-yl)ethanone Traditional Name: 2-[[4-amino-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]thio]-1-(2-methylmorpholino)ethanone Formula: C19H23ClN4O2S MolecularWeight: 406.92952

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)SCC(=O)N2CCOC(C2)C)N)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCC1=C(C(=NC(=N1)SCC(=O)N2CCOC(C2)C)N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H23ClN4O2S/c1-3-15-17(13-4-6-14(20)7-5-13)18(21)23-19(22-15)27-11-16(25)24-8-9-26-12(2)10-24/h4-7,12H,3,8-11H2,1-2H3,(H2,21,22,23)