methyl 2-[4-oxidanylidene-2-[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]sulfanyl-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[4-oxidanylidene-2-[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]sulfanyl-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[(1R)-2-anilino-1-methyl-2-oxo-ethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[[(2R)-1-anilino-1-oxopropan-2-yl]thio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(2R)-1-anilino-1-oxopropan-2-yl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[2-[[(1R)-2-anilino-2-keto-1-methyl-ethyl]thio]-4-keto-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C16H17N3O4S MolecularWeight: 347.38888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)SC2=NC(=O)C=C(N2)CC(=O)OC

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1)SC2=NC(=O)C=C(N2)CC(=O)OC

InChI

InChI=1S/C16H17N3O4S/c1-10(15(22)17-11-6-4-3-5-7-11)24-16-18-12(8-13(20)19-16)9-14(21)23-2/h3-8,10H,9H2,1-2H3,(H,17,22)(H,18,19,20)/t10-/m1/s1