ethyl 4-azanyl-2-[2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-2-oxo-ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-oxoethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-oxoethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-[homoveratryl(methyl)amino]-2-keto-ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C20H26N4O5S MolecularWeight: 434.50924

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)N(C)CCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)N(C)CCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C20H26N4O5S/c1-5-29-19(26)14-11-22-20(23-18(14)21)30-12-17(25)24(2)9-8-13-6-7-15(27-3)16(10-13)28-4/h6-7,10-11H,5,8-9,12H2,1-4H3,(H2,21,22,23)