propan-2-yl 6-[3-(butylcarbamoylamino)phenyl]-3,4-dimethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: propan-2-yl 6-[3-(butylcarbamoylamino)phenyl]-3,4-dimethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isopropyl 6-[3-(butylcarbamoylamino)phenyl]-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[3-[[butylamino(oxo)methyl]amino]phenyl]-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 6-[3-(butylcarbamoylamino)phenyl]-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[3-(butylcarbamoylamino)phenyl]-2-keto-3,4-dimethyl-1,6-dihydropyrimidine-5-carboxylic acid isopropyl ester Formula: C21H30N4O4 MolecularWeight: 402.4873

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=CC=CC(=C1)C2C(=C(N(C(=O)N2)C)C)C(=O)OC(C)C

Isomeric SMILES

CCCCNC(=O)NC1=CC=CC(=C1)C2C(=C(N(C(=O)N2)C)C)C(=O)OC(C)C

InChI

InChI=1S/C21H30N4O4/c1-6-7-11-22-20(27)23-16-10-8-9-15(12-16)18-17(19(26)29-13(2)3)14(4)25(5)21(28)24-18/h8-10,12-13,18H,6-7,11H2,1-5H3,(H,24,28)(H2,22,23,27)