ethyl 6-[[(5-chloranylthiophen-2-yl)methyl-ethyl-amino]methyl]-4-(furan-2-yl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[[(5-chloranylthiophen-2-yl)methyl-ethyl-amino]methyl]-4-(furan-2-yl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[(5-chloro-2-thienyl)methyl-ethyl-amino]methyl]-4-(2-furyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[(5-chloro-2-thiophenyl)methyl-ethylamino]methyl]-4-(2-furanyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[(5-chlorothiophen-2-yl)methyl-ethylamino]methyl]-4-(furan-2-yl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[(5-chloro-2-thienyl)methyl-ethyl-amino]methyl]-4-(2-furyl)-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C19H22ClN3O4S MolecularWeight: 423.91368

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Cl)CC2=C(C(NC(=O)N2)C3=CC=CO3)C(=O)OCC

Isomeric SMILES

CCN(CC1=CC=C(S1)Cl)CC2=C(C(NC(=O)N2)C3=CC=CO3)C(=O)OCC

InChI

InChI=1S/C19H22ClN3O4S/c1-3-23(10-12-7-8-15(20)28-12)11-13-16(18(24)26-4-2)17(22-19(25)21-13)14-6-5-9-27-14/h5-9,17H,3-4,10-11H2,1-2H3,(H2,21,22,25)