methyl (2R)-4-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoyl]thiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoyl]thiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylacetyl]thiomorpholine-2-carboxylate CAS Name: (2R)-4-[2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-oxoethyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetyl]thiomorpholine-2-carboxylate Traditional Name: (2R)-4-[2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]acetyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C19H21N3O3S2 MolecularWeight: 403.51834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N3CCSC(C3)C(=O)OC

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N3CCS[C@H](C3)C(=O)OC

InChI

InChI=1S/C19H21N3O3S2/c1-13-10-15(14-6-4-3-5-7-14)21-19(20-13)27-12-17(23)22-8-9-26-16(11-22)18(24)25-2/h3-7,10,16H,8-9,11-12H2,1-2H3/t16-/m1/s1