ethyl (6S)-3-ethyl-4-[(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-2-oxidanylidene-6-phenyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl (6S)-3-ethyl-4-[(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-2-oxidanylidene-6-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl (6S)-3-ethyl-4-[(3-methyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-3-ethyl-4-[[(3-methyl-4-oxo-2-quinazolinyl)thio]methyl]-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (6S)-3-ethyl-4-[(3-methyl-4-oxoquinazolin-2-yl)sulfanylmethyl]-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-3-ethyl-2-keto-4-[[(4-keto-3-methyl-quinazolin-2-yl)thio]methyl]-6-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C25H26N4O4S MolecularWeight: 478.56334

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=CC=CC=C2)C(=O)OCC)CSC3=NC4=CC=CC=C4C(=O)N3C

Isomeric SMILES

CCN1C(=C([C@@H](NC1=O)C2=CC=CC=C2)C(=O)OCC)CSC3=NC4=CC=CC=C4C(=O)N3C

InChI

InChI=1S/C25H26N4O4S/c1-4-29-19(15-34-25-26-18-14-10-9-13-17(18)22(30)28(25)3)20(23(31)33-5-2)21(27-24(29)32)16-11-7-6-8-12-16/h6-14,21H,4-5,15H2,1-3H3,(H,27,32)/t21-/m0/s1