5-(4-chlorophenyl)-6-[2-(5-methylsulfanylpyrimidin-2-yl)oxyethoxy]-1,2-dihydropyrimidine-2-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-6-[2-(5-methylsulfanylpyrimidin-2-yl)oxyethoxy]-1,2-dihydropyrimidine-2-carboxamide Openeye Name: 5-(4-chlorophenyl)-6-[2-(5-methylsulfanylpyrimidin-2-yl)oxyethoxy]-1,2-dihydropyrimidine-2-carboxamide CAS Name: 5-(4-chlorophenyl)-6-[2-[[5-(methylthio)-2-pyrimidinyl]oxy]ethoxy]-1,2-dihydropyrimidine-2-carboxamide IUPAC Name: 5-(4-chlorophenyl)-6-[2-(5-methylsulfanylpyrimidin-2-yl)oxyethoxy]-1,2-dihydropyrimidine-2-carboxamide Traditional Name: 5-(4-chlorophenyl)-6-[2-[5-(methylthio)pyrimidin-2-yl]oxyethoxy]-1,2-dihydropyrimidine-2-carboxamide Formula: C18H18ClN5O3S MolecularWeight: 419.88522

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CN=C(N=C1)OCCOC2=C(C=NC(N2)C(=O)N)C3=CC=C(C=C3)Cl

Isomeric SMILES

CSC1=CN=C(N=C1)OCCOC2=C(C=NC(N2)C(=O)N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18ClN5O3S/c1-28-13-8-22-18(23-9-13)27-7-6-26-17-14(10-21-16(24-17)15(20)25)11-2-4-12(19)5-3-11/h2-5,8-10,16,24H,6-7H2,1H3,(H2,20,25)