ethyl 4-azanyl-2-[2-[methyl-(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[2-[methyl-(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[2-(N,3-dimethylanilino)-2-oxo-ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[2-(N,3-dimethylanilino)-2-oxoethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[2-(N,3-dimethylanilino)-2-oxoethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-(N,3-dimethylanilino)-2-keto-ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C17H20N4O3S MolecularWeight: 360.4307

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)N(C)C2=CC=CC(=C2)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)N(C)C2=CC=CC(=C2)C

InChI

InChI=1S/C17H20N4O3S/c1-4-24-16(23)13-9-19-17(20-15(13)18)25-10-14(22)21(3)12-7-5-6-11(2)8-12/h5-9H,4,10H2,1-3H3,(H2,18,19,20)