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

Systemtic Name: ethyl 6-[[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylmethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[2-(morpholinomethyl)quinazolin-4-yl]sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[[2-(4-morpholinylmethyl)-4-quinazolinyl]thio]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-6-[[[2-(morpholinomethyl)quinazolin-4-yl]thio]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H25N5O4S MolecularWeight: 443.5193

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)CSC2=NC(=NC3=CC=CC=C32)CN4CCOCC4

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CSC2=NC(=NC3=CC=CC=C32)CN4CCOCC4

InChI

InChI=1S/C21H25N5O4S/c1-2-30-20(27)15-11-22-21(28)24-17(15)13-31-19-14-5-3-4-6-16(14)23-18(25-19)12-26-7-9-29-10-8-26/h3-6H,2,7-13H2,1H3,(H2,22,24,28)