ethyl 1-(diphenylmethyl)-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carboxylate

Systemtic Name: ethyl 1-(diphenylmethyl)-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carboxylate Openeye Name: ethyl 1-benzhydryl-2-methylsulfanyl-6-oxo-pyrimidine-5-carboxylate CAS Name: 1-(diphenylmethyl)-2-(methylthio)-6-oxo-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzhydryl-2-methylsulfanyl-6-oxopyrimidine-5-carboxylate Traditional Name: 1-benzhydryl-6-keto-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N(C1=O)C(C2=CC=CC=C2)C3=CC=CC=C3)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1=O)C(C2=CC=CC=C2)C3=CC=CC=C3)SC

InChI

InChI=1S/C21H20N2O3S/c1-3-26-20(25)17-14-22-21(27-2)23(19(17)24)18(15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-14,18H,3H2,1-2H3