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

Systemtic Name: ethyl 6-methyl-4-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl]sulfanyl-2-oxidanylidene-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-methyl-4-[2-(1-naphthylamino)-2-oxo-ethyl]sulfanyl-2-oxo-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-4-[[2-(1-naphthalenylamino)-2-oxoethyl]thio]-2-oxo-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-methyl-4-[2-(naphthalen-1-ylamino)-2-oxoethyl]sulfanyl-2-oxo-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-4-[[2-keto-2-(1-naphthylamino)ethyl]thio]-6-methyl-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)N=C1SCC(=O)NC2=CC=CC3=CC=CC=C32)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N=C1SCC(=O)NC2=CC=CC3=CC=CC=C32)C

InChI

InChI=1S/C20H19N3O4S/c1-3-27-19(25)17-12(2)21-20(26)23-18(17)28-11-16(24)22-15-10-6-8-13-7-4-5-9-14(13)15/h4-10H,3,11H2,1-2H3,(H,22,24)(H,21,23,26)