ethyl 5-azanyl-1-[4-(butylcarbamoyl)phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[4-(butylcarbamoyl)phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[4-(butylcarbamoyl)phenyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[4-[butylamino(oxo)methyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[4-(butylcarbamoyl)phenyl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[4-(butylcarbamoyl)phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C17H22N4O3 MolecularWeight: 330.38158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)OCC)N

Isomeric SMILES

CCCCNC(=O)C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)OCC)N

InChI

InChI=1S/C17H22N4O3/c1-3-5-10-19-16(22)12-6-8-13(9-7-12)21-15(18)14(11-20-21)17(23)24-4-2/h6-9,11H,3-5,10,18H2,1-2H3,(H,19,22)