ethyl 4-azanyl-2-[1-[(2,4-dimethylphenyl)carbamoylamino]-1-oxidanylidene-propan-2-yl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[1-[(2,4-dimethylphenyl)carbamoylamino]-1-oxidanylidene-propan-2-yl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[2-[(2,4-dimethylphenyl)carbamoylamino]-1-methyl-2-oxo-ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[1-[[(2,4-dimethylanilino)-oxomethyl]amino]-1-oxopropan-2-yl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[1-[(2,4-dimethylphenyl)carbamoylamino]-1-oxopropan-2-yl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-[(2,4-dimethylphenyl)carbamoylamino]-2-keto-1-methyl-ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C19H23N5O4S MolecularWeight: 417.48202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SC(C)C(=O)NC(=O)NC2=C(C=C(C=C2)C)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SC(C)C(=O)NC(=O)NC2=C(C=C(C=C2)C)C

InChI

InChI=1S/C19H23N5O4S/c1-5-28-17(26)13-9-21-19(23-15(13)20)29-12(4)16(25)24-18(27)22-14-7-6-10(2)8-11(14)3/h6-9,12H,5H2,1-4H3,(H2,20,21,23)(H2,22,24,25,27)