ethyl 2-(6-azanyl-4-oxidanylidene-1-phenethyl-pyrimidin-2-yl)sulfanylethanoate

Systemtic Name: ethyl 2-(6-azanyl-4-oxidanylidene-1-phenethyl-pyrimidin-2-yl)sulfanylethanoate Openeye Name: ethyl 2-(6-amino-4-oxo-1-phenethyl-pyrimidin-2-yl)sulfanylacetate CAS Name: 2-[(6-amino-4-oxo-1-phenethyl-2-pyrimidinyl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(6-amino-4-oxo-1-phenethylpyrimidin-2-yl)sulfanylacetate Traditional Name: 2-[(6-amino-4-keto-1-phenethyl-pyrimidin-2-yl)thio]acetic acid ethyl ester Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=O)C=C(N1CCC2=CC=CC=C2)N

Isomeric SMILES

CCOC(=O)CSC1=NC(=O)C=C(N1CCC2=CC=CC=C2)N

InChI

InChI=1S/C16H19N3O3S/c1-2-22-15(21)11-23-16-18-14(20)10-13(17)19(16)9-8-12-6-4-3-5-7-12/h3-7,10H,2,8-9,11,17H2,1H3