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

Systemtic Name: ethyl 2-[2-(4,6-dimethyl-2-oxidanylidene-pyrimidin-1-yl)propanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[2-(4,6-dimethyl-2-oxo-pyrimidin-1-yl)propanoylamino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-(4,6-dimethyl-2-oxo-1-pyrimidinyl)-1-oxopropyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)propanoylamino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[2-(2-keto-4,6-dimethyl-pyrimidin-1-yl)propanoylamino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(C)N3C(=CC(=NC3=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(C)N3C(=CC(=NC3=O)C)C

InChI

InChI=1S/C22H23N3O4S/c1-5-29-21(27)18-17(16-9-7-6-8-10-16)12-30-20(18)24-19(26)15(4)25-14(3)11-13(2)23-22(25)28/h6-12,15H,5H2,1-4H3,(H,24,26)