ethyl 4-azanyl-2-[(1S)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[(1S)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[(1S)-2-morpholino-2-oxo-1-phenyl-ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[(1S)-2-(4-morpholinyl)-2-oxo-1-phenylethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[(1S)-2-keto-2-morpholino-1-phenyl-ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C19H22N4O4S MolecularWeight: 402.46738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SC(C2=CC=CC=C2)C(=O)N3CCOCC3

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)S[C@@H](C2=CC=CC=C2)C(=O)N3CCOCC3

InChI

InChI=1S/C19H22N4O4S/c1-2-27-18(25)14-12-21-19(22-16(14)20)28-15(13-6-4-3-5-7-13)17(24)23-8-10-26-11-9-23/h3-7,12,15H,2,8-11H2,1H3,(H2,20,21,22)/t15-/m0/s1