ethyl 4-methyl-6-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-methyl-6-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-2-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-methyl-6-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-methyl-6-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-2-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-6-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-[(2-keto-2-pyrrolidino-ethyl)thio]-6-methyl-2-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1SCC(=O)N2CCCC2)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1SCC(=O)N2CCCC2)C3=CC=CC=C3)C

InChI

InChI=1S/C20H23N3O3S/c1-3-26-20(25)17-14(2)21-18(15-9-5-4-6-10-15)22-19(17)27-13-16(24)23-11-7-8-12-23/h4-6,9-10H,3,7-8,11-13H2,1-2H3