ethyl 2,6-dimethyl-4-[(3-methylsulfanylphenyl)amino]furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 2,6-dimethyl-4-[(3-methylsulfanylphenyl)amino]furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 2,6-dimethyl-4-(3-methylsulfanylanilino)furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 2,6-dimethyl-4-[3-(methylthio)anilino]-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2,6-dimethyl-4-(3-methylsulfanylanilino)furo[2,3-d]pyrimidine-5-carboxylate Traditional Name: 2,6-dimethyl-4-[3-(methylthio)anilino]furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)NC3=CC(=CC=C3)SC)C)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)NC3=CC(=CC=C3)SC)C)C

InChI

InChI=1S/C18H19N3O3S/c1-5-23-18(22)14-10(2)24-17-15(14)16(19-11(3)20-17)21-12-7-6-8-13(9-12)25-4/h6-9H,5H2,1-4H3,(H,19,20,21)