ethyl 2-oxidanylidene-6-[[1-(oxolan-2-ylmethyl)-5-phenyl-imidazol-2-yl]sulfanylmethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-oxidanylidene-6-[[1-(oxolan-2-ylmethyl)-5-phenyl-imidazol-2-yl]sulfanylmethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-oxo-6-[[5-phenyl-1-(tetrahydrofuran-2-ylmethyl)imidazol-2-yl]sulfanylmethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 2-oxo-6-[[[1-(2-oxolanylmethyl)-5-phenyl-2-imidazolyl]thio]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-oxo-6-[[1-(oxolan-2-ylmethyl)-5-phenylimidazol-2-yl]sulfanylmethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-6-[[[5-phenyl-1-(tetrahydrofurfuryl)imidazol-2-yl]thio]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H26N4O4S MolecularWeight: 442.53124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)CSC2=NC=C(N2CC3CCCO3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CSC2=NC=C(N2CC3CCCO3)C4=CC=CC=C4

InChI

InChI=1S/C22H26N4O4S/c1-2-29-20(27)17-11-23-21(28)25-18(17)14-31-22-24-12-19(15-7-4-3-5-8-15)26(22)13-16-9-6-10-30-16/h3-5,7-8,12,16H,2,6,9-11,13-14H2,1H3,(H2,23,25,28)