ethyl 5-methyl-1-[4-[[1-oxidanylidene-1-(propylamino)propan-2-yl]carbamoyl]phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-1-[4-[[1-oxidanylidene-1-(propylamino)propan-2-yl]carbamoyl]phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-[4-[[1-methyl-2-oxo-2-(propylamino)ethyl]carbamoyl]phenyl]pyrazole-4-carboxylate CAS Name: 5-methyl-1-[4-[oxo-[[1-oxo-1-(propylamino)propan-2-yl]amino]methyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[4-[[1-oxo-1-(propylamino)propan-2-yl]carbamoyl]phenyl]pyrazole-4-carboxylate Traditional Name: 1-[4-[[2-keto-1-methyl-2-(propylamino)ethyl]carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C20H26N4O4 MolecularWeight: 386.44484

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)OCC)C

Isomeric SMILES

CCCNC(=O)C(C)NC(=O)C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)OCC)C

InChI

InChI=1S/C20H26N4O4/c1-5-11-21-18(25)13(3)23-19(26)15-7-9-16(10-8-15)24-14(4)17(12-22-24)20(27)28-6-2/h7-10,12-13H,5-6,11H2,1-4H3,(H,21,25)(H,23,26)