methyl 2-[4-oxidanylidene-2-[2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl]sulfanyl-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[4-oxidanylidene-2-[2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl]sulfanyl-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[4-oxo-2-[2-oxo-2-[4-(propanoylamino)phenyl]ethyl]sulfanyl-1H-pyrimidin-6-yl]acetate CAS Name: 2-[4-oxo-2-[[2-oxo-2-[4-(1-oxopropylamino)phenyl]ethyl]thio]-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4-oxo-2-[2-oxo-2-[4-(propanoylamino)phenyl]ethyl]sulfanyl-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[4-keto-2-[[2-keto-2-(4-propionamidophenyl)ethyl]thio]-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC(=O)C=C(N2)CC(=O)OC

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC(=O)C=C(N2)CC(=O)OC

InChI

InChI=1S/C18H19N3O5S/c1-3-15(23)19-12-6-4-11(5-7-12)14(22)10-27-18-20-13(8-16(24)21-18)9-17(25)26-2/h4-8H,3,9-10H2,1-2H3,(H,19,23)(H,20,21,24)