ethyl 5-azanyl-1-[4-[(2,5-dimethoxyphenyl)methylcarbamoyl]phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[4-[(2,5-dimethoxyphenyl)methylcarbamoyl]phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[4-[(2,5-dimethoxyphenyl)methylcarbamoyl]phenyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[4-[[(2,5-dimethoxyphenyl)methylamino]-oxomethyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[4-[(2,5-dimethoxyphenyl)methylcarbamoyl]phenyl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[4-[(2,5-dimethoxybenzyl)carbamoyl]phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C22H24N4O5 MolecularWeight: 424.44976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NCC3=C(C=CC(=C3)OC)OC)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NCC3=C(C=CC(=C3)OC)OC)N

InChI

InChI=1S/C22H24N4O5/c1-4-31-22(28)18-13-25-26(20(18)23)16-7-5-14(6-8-16)21(27)24-12-15-11-17(29-2)9-10-19(15)30-3/h5-11,13H,4,12,23H2,1-3H3,(H,24,27)