ethyl 3-(3-methylphenyl)-4-oxidanylidene-2-piperazin-1-yl-5H-pyrazolo[1,5-a]pyrazine-6-carboxylate hydrochloride

Systemtic Name: ethyl 3-(3-methylphenyl)-4-oxidanylidene-2-piperazin-1-yl-5H-pyrazolo[1,5-a]pyrazine-6-carboxylate hydrochloride Openeye Name: ethyl 3-(m-tolyl)-4-oxo-2-piperazin-1-yl-5H-pyrazolo[1,5-a]pyrazine-6-carboxylate hydrochloride CAS Name: 3-(3-methylphenyl)-4-oxo-2-(1-piperazinyl)-5H-pyrazolo[1,5-a]pyrazine-6-carboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 3-(3-methylphenyl)-4-oxo-2-piperazin-1-yl-5H-pyrazolo[1,5-a]pyrazine-6-carboxylate hydrochloride Traditional Name: 4-keto-3-(m-tolyl)-2-piperazino-5H-pyrazolo[1,5-a]pyrazine-6-carboxylic acid ethyl ester hydrochloride Formula: C20H24ClN5O3 MolecularWeight: 417.88926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN2C(=C(C(=N2)N3CCNCC3)C4=CC(=CC=C4)C)C(=O)N1.Cl

Isomeric SMILES

CCOC(=O)C1=CN2C(=C(C(=N2)N3CCNCC3)C4=CC(=CC=C4)C)C(=O)N1.Cl

InChI

InChI=1S/C20H23N5O3.ClH/c1-3-28-20(27)15-12-25-17(19(26)22-15)16(14-6-4-5-13(2)11-14)18(23-25)24-9-7-21-8-10-24;/h4-6,11-12,21H,3,7-10H2,1-2H3,(H,22,26);1H