ethyl 3-[2-[2-[methyl(pyrimidin-2-yl)amino]ethanoyloxy]ethanoylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[2-[2-[methyl(pyrimidin-2-yl)amino]ethanoyloxy]ethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[2-[2-[methyl(pyrimidin-2-yl)amino]acetyl]oxyacetyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2-[2-[methyl(2-pyrimidinyl)amino]-1-oxoethoxy]-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-[2-[methyl(pyrimidin-2-yl)amino]acetyl]oxyacetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-[2-[methyl(2-pyrimidyl)amino]acetyl]oxyacetyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C22H22N4O5S MolecularWeight: 454.49888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)COC(=O)CN(C)C3=NC=CC=N3

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)COC(=O)CN(C)C3=NC=CC=N3

InChI

InChI=1S/C22H22N4O5S/c1-3-30-21(29)20-16(12-17(32-20)15-8-5-4-6-9-15)25-18(27)14-31-19(28)13-26(2)22-23-10-7-11-24-22/h4-12H,3,13-14H2,1-2H3,(H,25,27)