ethyl 4-azanyl-2-[(1R)-1-phenylethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[(1R)-1-phenylethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[(1R)-1-phenylethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[(1R)-1-phenylethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[(1R)-1-phenylethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[(1R)-1-phenylethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C15H17N3O2S MolecularWeight: 303.37938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17N3O2S/c1-3-20-14(19)12-9-17-15(18-13(12)16)21-10(2)11-7-5-4-6-8-11/h4-10H,3H2,1-2H3,(H2,16,17,18)/t10-/m1/s1