methyl 2-[6-methyl-4-oxidanylidene-2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-1H-pyrimidin-5-yl]ethanoate

Systemtic Name: methyl 2-[6-methyl-4-oxidanylidene-2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-1H-pyrimidin-5-yl]ethanoate Openeye Name: methyl 2-[2-(2-anilino-2-oxo-ethyl)sulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetate CAS Name: 2-[2-[(2-anilino-2-oxoethyl)thio]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(2-anilino-2-oxoethyl)sulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetate Traditional Name: 2-[2-[(2-anilino-2-keto-ethyl)thio]-4-keto-6-methyl-1H-pyrimidin-5-yl]acetic acid methyl ester Formula: C16H17N3O4S MolecularWeight: 347.38888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC(=O)NC2=CC=CC=C2)CC(=O)OC

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC(=O)NC2=CC=CC=C2)CC(=O)OC

InChI

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