methyl 2-[2-[3-(4-chloranylphenoxy)propylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[3-(4-chloranylphenoxy)propylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[3-(4-chlorophenoxy)propylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[3-(4-chlorophenoxy)propylthio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[3-(4-chlorophenoxy)propylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[2-[3-(4-chlorophenoxy)propylthio]-4-keto-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C16H17ClN2O4S MolecularWeight: 368.83518

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=O)N=C(N1)SCCCOC2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)CC1=CC(=O)N=C(N1)SCCCOC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H17ClN2O4S/c1-22-15(21)10-12-9-14(20)19-16(18-12)24-8-2-7-23-13-5-3-11(17)4-6-13/h3-6,9H,2,7-8,10H2,1H3,(H,18,19,20)