ethyl 1-[4-[[2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[4-[[2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-[[2-(tert-butylamino)-2-oxo-ethyl]-methyl-carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[4-[[[2-(tert-butylamino)-2-oxoethyl]-methylamino]-oxomethyl]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[[2-(tert-butylamino)-2-oxoethyl]-methylcarbamoyl]phenyl]-5-methylpyrazole-4-carboxylate Traditional Name: 1-[4-[[2-(tert-butylamino)-2-keto-ethyl]-methyl-carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C21H28N4O4 MolecularWeight: 400.47142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)N(C)CC(=O)NC(C)(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)N(C)CC(=O)NC(C)(C)C)C

InChI

InChI=1S/C21H28N4O4/c1-7-29-20(28)17-12-22-25(14(17)2)16-10-8-15(9-11-16)19(27)24(6)13-18(26)23-21(3,4)5/h8-12H,7,13H2,1-6H3,(H,23,26)