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

Systemtic Name: ethyl 3-butyl-6-[3-(cyclohexylcarbamoylamino)phenyl]-2-oxidanylidene-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-butyl-6-[3-(cyclohexylcarbamoylamino)phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-butyl-6-[3-[[(cyclohexylamino)-oxomethyl]amino]phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-butyl-6-[3-(cyclohexylcarbamoylamino)phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-butyl-6-[3-(cyclohexylcarbamoylamino)phenyl]-2-keto-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C30H38N4O4 MolecularWeight: 518.64712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)NC3CCCCC3)C(=O)OCC)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)NC3CCCCC3)C(=O)OCC)C4=CC=CC=C4

InChI

InChI=1S/C30H38N4O4/c1-3-5-19-34-27(21-13-8-6-9-14-21)25(28(35)38-4-2)26(33-30(34)37)22-15-12-18-24(20-22)32-29(36)31-23-16-10-7-11-17-23/h6,8-9,12-15,18,20,23,26H,3-5,7,10-11,16-17,19H2,1-2H3,(H,33,37)(H2,31,32,36)