methyl 3-methyl-4-[(2R)-1-[(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)carbonyl]pyrrolidin-2-yl]benzoate

Systemtic Name: methyl 3-methyl-4-[(2R)-1-[(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)carbonyl]pyrrolidin-2-yl]benzoate Openeye Name: methyl 3-methyl-4-[(2R)-1-(4-oxo-2-thioxo-1H-pyrimidine-5-carbonyl)pyrrolidin-2-yl]benzoate CAS Name: 3-methyl-4-[(2R)-1-[oxo-(4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)methyl]-2-pyrrolidinyl]benzoic acid methyl ester IUPAC Name: methyl 3-methyl-4-[(2R)-1-(4-oxo-2-sulfanylidene-1H-pyrimidine-5-carbonyl)pyrrolidin-2-yl]benzoate Traditional Name: 4-[(2R)-1-(4-keto-2-thioxo-1H-pyrimidine-5-carbonyl)pyrrolidin-2-yl]-3-methyl-benzoic acid methyl ester Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC)C2CCCN2C(=O)C3=CNC(=S)NC3=O

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC)[C@H]2CCCN2C(=O)C3=CNC(=S)NC3=O

InChI

InChI=1S/C18H19N3O4S/c1-10-8-11(17(24)25-2)5-6-12(10)14-4-3-7-21(14)16(23)13-9-19-18(26)20-15(13)22/h5-6,8-9,14H,3-4,7H2,1-2H3,(H2,19,20,22,26)/t14-/m1/s1