methyl 2-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoylamino]ethanoate Openeye Name: methyl 2-[[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylacetyl]amino]acetate CAS Name: 2-[[2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetyl]amino]acetate Traditional Name: 2-[[2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]acetyl]amino]acetic acid methyl ester Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NCC(=O)OC

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NCC(=O)OC

InChI

InChI=1S/C16H17N3O3S/c1-11-8-13(12-6-4-3-5-7-12)19-16(18-11)23-10-14(20)17-9-15(21)22-2/h3-8H,9-10H2,1-2H3,(H,17,20)