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

Systemtic Name: ethyl 6-[3-(cyclohexylcarbamoylamino)phenyl]-2-oxidanylidene-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-[3-(cyclohexylcarbamoylamino)phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[3-[[(cyclohexylamino)-oxomethyl]amino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[3-(cyclohexylcarbamoylamino)phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[3-(cyclohexylcarbamoylamino)phenyl]-2-keto-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C29H36N4O4 MolecularWeight: 504.62054

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)NC3CCCCC3)C(=O)OCC)C4=CC=CC=C4

Isomeric SMILES

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)NC3CCCCC3)C(=O)OCC)C4=CC=CC=C4

InChI

InChI=1S/C29H36N4O4/c1-3-18-33-26(20-12-7-5-8-13-20)24(27(34)37-4-2)25(32-29(33)36)21-14-11-17-23(19-21)31-28(35)30-22-15-9-6-10-16-22/h5,7-8,11-14,17,19,22,25H,3-4,6,9-10,15-16,18H2,1-2H3,(H,32,36)(H2,30,31,35)