ethyl 3-ethyl-4-methyl-2-sulfanylidene-6-[3-(tetradecanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3-ethyl-4-methyl-2-sulfanylidene-6-[3-(tetradecanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-ethyl-4-methyl-6-[3-(tetradecanoylamino)phenyl]-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-ethyl-4-methyl-6-[3-(1-oxotetradecylamino)phenyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-ethyl-4-methyl-2-sulfanylidene-6-[3-(tetradecanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-ethyl-4-methyl-6-[3-(tetradecanoylamino)phenyl]-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C30H47N3O3S MolecularWeight: 529.77748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)NC1=CC=CC(=C1)C2C(=C(N(C(=S)N2)CC)C)C(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCCC(=O)NC1=CC=CC(=C1)C2C(=C(N(C(=S)N2)CC)C)C(=O)OCC

InChI

InChI=1S/C30H47N3O3S/c1-5-8-9-10-11-12-13-14-15-16-17-21-26(34)31-25-20-18-19-24(22-25)28-27(29(35)36-7-3)23(4)33(6-2)30(37)32-28/h18-20,22,28H,5-17,21H2,1-4H3,(H,31,34)(H,32,37)