ethyl 4-(5-methylfuran-2-yl)-2-oxidanylidene-6-[[(E)-3-thiophen-3-ylprop-2-enoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(5-methylfuran-2-yl)-2-oxidanylidene-6-[[(E)-3-thiophen-3-ylprop-2-enoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(5-methyl-2-furyl)-2-oxo-6-[[(E)-3-(3-thienyl)prop-2-enoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(5-methyl-2-furanyl)-2-oxo-6-[[(E)-1-oxo-3-(3-thiophenyl)prop-2-enoxy]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(5-methylfuran-2-yl)-2-oxo-6-[[(E)-3-thiophen-3-ylprop-2-enoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-4-(5-methyl-2-furyl)-6-[[(E)-3-(3-thienyl)acryloyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H20N2O6S MolecularWeight: 416.4476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(O2)C)COC(=O)C=CC3=CSC=C3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(O2)C)COC(=O)/C=C/C3=CSC=C3

InChI

InChI=1S/C20H20N2O6S/c1-3-26-19(24)17-14(10-27-16(23)7-5-13-8-9-29-11-13)21-20(25)22-18(17)15-6-4-12(2)28-15/h4-9,11,18H,3,10H2,1-2H3,(H2,21,22,25)/b7-5+