ethyl 5-[[(4-tert-butylphenyl)carbonylamino]carbamoyl]-2,6-dimethyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-[[(4-tert-butylphenyl)carbonylamino]carbamoyl]-2,6-dimethyl-pyridine-3-carboxylate Openeye Name: ethyl 5-[[(4-tert-butylbenzoyl)amino]carbamoyl]-2,6-dimethyl-pyridine-3-carboxylate CAS Name: 5-[[[(4-tert-butylphenyl)-oxomethyl]hydrazo]-oxomethyl]-2,6-dimethyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[(4-tert-butylbenzoyl)amino]carbamoyl]-2,6-dimethylpyridine-3-carboxylate Traditional Name: 5-[[(4-tert-butylbenzoyl)amino]carbamoyl]-2,6-dimethyl-nicotinic acid ethyl ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4/c1-7-29-21(28)18-12-17(13(2)23-14(18)3)20(27)25-24-19(26)15-8-10-16(11-9-15)22(4,5)6/h8-12H,7H2,1-6H3,(H,24,26)(H,25,27)