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

Systemtic Name: methyl 2-[2-[2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[[2-(cyclopropylamino)-2-oxo-1-phenylethyl]thio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-(cyclopropylamino)-2-oxo-1-phenylethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[2-[[2-(cyclopropylamino)-2-keto-1-phenyl-ethyl]thio]-4-keto-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=O)N=C(N1)SC(C2=CC=CC=C2)C(=O)NC3CC3

Isomeric SMILES

COC(=O)CC1=CC(=O)N=C(N1)SC(C2=CC=CC=C2)C(=O)NC3CC3

InChI

InChI=1S/C18H19N3O4S/c1-25-15(23)10-13-9-14(22)21-18(20-13)26-16(11-5-3-2-4-6-11)17(24)19-12-7-8-12/h2-6,9,12,16H,7-8,10H2,1H3,(H,19,24)(H,20,21,22)