ethyl 2-[2-(4,6-dimethyl-2-oxidanylidene-pyrimidin-1-yl)ethanoylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(4,6-dimethyl-2-oxidanylidene-pyrimidin-1-yl)ethanoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4,6-dimethyl-2-oxo-pyrimidin-1-yl)acetyl]amino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-(4,6-dimethyl-2-oxo-1-pyrimidinyl)-1-oxoethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)acetyl]amino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(2-keto-4,6-dimethyl-pyrimidin-1-yl)acetyl]amino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)CN3C(=CC(=NC3=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)CN3C(=CC(=NC3=O)C)C

InChI

InChI=1S/C21H21N3O4S/c1-4-28-20(26)16-11-17(15-8-6-5-7-9-15)29-19(16)23-18(25)12-24-14(3)10-13(2)22-21(24)27/h5-11H,4,12H2,1-3H3,(H,23,25)