ethyl 5-azanyl-1-[4-[(3,5-dimethoxyphenyl)carbamoyl]phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[4-[(3,5-dimethoxyphenyl)carbamoyl]phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[4-[(3,5-dimethoxyphenyl)carbamoyl]phenyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[4-[(3,5-dimethoxyanilino)-oxomethyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[4-[(3,5-dimethoxyphenyl)carbamoyl]phenyl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[4-[(3,5-dimethoxyphenyl)carbamoyl]phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C21H22N4O5 MolecularWeight: 410.42318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NC3=CC(=CC(=C3)OC)OC)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NC3=CC(=CC(=C3)OC)OC)N

InChI

InChI=1S/C21H22N4O5/c1-4-30-21(27)18-12-23-25(19(18)22)15-7-5-13(6-8-15)20(26)24-14-9-16(28-2)11-17(10-14)29-3/h5-12H,4,22H2,1-3H3,(H,24,26)