ethyl 6-methyl-4-[2-[(4-methylphenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-2-oxidanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-methyl-4-[2-[(4-methylphenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-2-oxidanylidene-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-methyl-2-oxo-4-[2-oxo-2-(p-tolylmethylamino)ethyl]sulfanyl-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-4-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]thio]-2-oxo-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-methyl-4-[2-[(4-methylphenyl)methylamino]-2-oxoethyl]sulfanyl-2-oxo-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-4-[[2-keto-2-[(4-methylbenzyl)amino]ethyl]thio]-6-methyl-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)N=C1SCC(=O)NCC2=CC=C(C=C2)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N=C1SCC(=O)NCC2=CC=C(C=C2)C)C

InChI

InChI=1S/C18H21N3O4S/c1-4-25-17(23)15-12(3)20-18(24)21-16(15)26-10-14(22)19-9-13-7-5-11(2)6-8-13/h5-8H,4,9-10H2,1-3H3,(H,19,22)(H,20,21,24)