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

Systemtic Name: ethyl 3-butyl-6-[4-(dimethylcarbamoylamino)phenyl]-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-butyl-6-[4-(dimethylcarbamoylamino)phenyl]-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-butyl-6-[4-[[dimethylamino(oxo)methyl]amino]phenyl]-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-butyl-6-[4-(dimethylcarbamoylamino)phenyl]-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-butyl-6-[4-(dimethylcarbamoylamino)phenyl]-2-keto-4-methyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C21H30N4O4 MolecularWeight: 402.4873

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(NC1=O)C2=CC=C(C=C2)NC(=O)N(C)C)C(=O)OCC)C

Isomeric SMILES

CCCCN1C(=C(C(NC1=O)C2=CC=C(C=C2)NC(=O)N(C)C)C(=O)OCC)C

InChI

InChI=1S/C21H30N4O4/c1-6-8-13-25-14(3)17(19(26)29-7-2)18(23-21(25)28)15-9-11-16(12-10-15)22-20(27)24(4)5/h9-12,18H,6-8,13H2,1-5H3,(H,22,27)(H,23,28)