ethyl 3,4-dimethyl-2-oxidanylidene-6-[3-(2-phenylsulfanylethanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3,4-dimethyl-2-oxidanylidene-6-[3-(2-phenylsulfanylethanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3,4-dimethyl-2-oxo-6-[3-[(2-phenylsulfanylacetyl)amino]phenyl]-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3,4-dimethyl-2-oxo-6-[3-[[1-oxo-2-(phenylthio)ethyl]amino]phenyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3,4-dimethyl-2-oxo-6-[3-[(2-phenylsulfanylacetyl)amino]phenyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 2-keto-3,4-dimethyl-6-[3-[[2-(phenylthio)acetyl]amino]phenyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C23H25N3O4S MolecularWeight: 439.5273

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=CC=C2)NC(=O)CSC3=CC=CC=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=CC=C2)NC(=O)CSC3=CC=CC=C3)C)C

InChI

InChI=1S/C23H25N3O4S/c1-4-30-22(28)20-15(2)26(3)23(29)25-21(20)16-9-8-10-17(13-16)24-19(27)14-31-18-11-6-5-7-12-18/h5-13,21H,4,14H2,1-3H3,(H,24,27)(H,25,29)