methyl 2-[2-[2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[2-(4-morpholinoanilino)-2-oxo-ethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[[2-[4-(4-morpholinyl)anilino]-2-oxoethyl]thio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[4-keto-2-[[2-keto-2-(4-morpholinoanilino)ethyl]thio]-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=O)N=C(N1)SCC(=O)NC2=CC=C(C=C2)N3CCOCC3

Isomeric SMILES

COC(=O)CC1=CC(=O)N=C(N1)SCC(=O)NC2=CC=C(C=C2)N3CCOCC3

InChI

InChI=1S/C19H22N4O5S/c1-27-18(26)11-14-10-16(24)22-19(21-14)29-12-17(25)20-13-2-4-15(5-3-13)23-6-8-28-9-7-23/h2-5,10H,6-9,11-12H2,1H3,(H,20,25)(H,21,22,24)