ethyl 4-[2-[(2,6-dimethylphenyl)carbamoylamino]ethylamino]-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[2-[(2,6-dimethylphenyl)carbamoylamino]ethylamino]-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[2-[(2,6-dimethylphenyl)carbamoylamino]ethylamino]-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-[2-[[(2,6-dimethylanilino)-oxomethyl]amino]ethylamino]-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(2,6-dimethylphenyl)carbamoylamino]ethylamino]-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-[2-[(2,6-dimethylphenyl)carbamoylamino]ethylamino]-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C19H25N5O3S MolecularWeight: 403.4985

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NCCNC(=O)NC2=C(C=CC=C2C)C)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NCCNC(=O)NC2=C(C=CC=C2C)C)SC

InChI

InChI=1S/C19H25N5O3S/c1-5-27-17(25)14-11-22-19(28-4)24-16(14)20-9-10-21-18(26)23-15-12(2)7-6-8-13(15)3/h6-8,11H,5,9-10H2,1-4H3,(H,20,22,24)(H2,21,23,26)