methyl 5-azanyl-1-[4-(4-propylpiperazin-1-yl)carbonylphenyl]pyrazole-4-carboxylate

Systemtic Name: methyl 5-azanyl-1-[4-(4-propylpiperazin-1-yl)carbonylphenyl]pyrazole-4-carboxylate Openeye Name: methyl 5-amino-1-[4-(4-propylpiperazine-1-carbonyl)phenyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[4-[oxo-(4-propyl-1-piperazinyl)methyl]phenyl]-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-amino-1-[4-(4-propylpiperazine-1-carbonyl)phenyl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[4-(4-propylpiperazine-1-carbonyl)phenyl]pyrazole-4-carboxylic acid methyl ester Formula: C19H25N5O3 MolecularWeight: 371.4335

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C(=O)C2=CC=C(C=C2)N3C(=C(C=N3)C(=O)OC)N

Isomeric SMILES

CCCN1CCN(CC1)C(=O)C2=CC=C(C=C2)N3C(=C(C=N3)C(=O)OC)N

InChI

InChI=1S/C19H25N5O3/c1-3-8-22-9-11-23(12-10-22)18(25)14-4-6-15(7-5-14)24-17(20)16(13-21-24)19(26)27-2/h4-7,13H,3,8-12,20H2,1-2H3