methyl (6S)-3-cyclopropyl-2-oxidanylidene-6-phenyl-4-(quinazolin-4-ylsulfanylmethyl)-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl (6S)-3-cyclopropyl-2-oxidanylidene-6-phenyl-4-(quinazolin-4-ylsulfanylmethyl)-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl (6S)-3-cyclopropyl-2-oxo-6-phenyl-4-(quinazolin-4-ylsulfanylmethyl)-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-3-cyclopropyl-2-oxo-6-phenyl-4-[(4-quinazolinylthio)methyl]-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (6S)-3-cyclopropyl-2-oxo-6-phenyl-4-(quinazolin-4-ylsulfanylmethyl)-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-3-cyclopropyl-2-keto-6-phenyl-4-[(quinazolin-4-ylthio)methyl]-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C24H22N4O3S MolecularWeight: 446.52148

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2)C3CC3)CSC4=NC=NC5=CC=CC=C54

Isomeric SMILES

COC(=O)C1=C(N(C(=O)N[C@H]1C2=CC=CC=C2)C3CC3)CSC4=NC=NC5=CC=CC=C54

InChI

InChI=1S/C24H22N4O3S/c1-31-23(29)20-19(13-32-22-17-9-5-6-10-18(17)25-14-26-22)28(16-11-12-16)24(30)27-21(20)15-7-3-2-4-8-15/h2-10,14,16,21H,11-13H2,1H3,(H,27,30)/t21-/m0/s1