3-methylbutyl 4-(6-azanyl-5-cyano-3-methyl-4-pyridin-3-yl-4H-pyrano[2,3-c]pyrazol-1-yl)benzoate

Systemtic Name: 3-methylbutyl 4-(6-azanyl-5-cyano-3-methyl-4-pyridin-3-yl-4H-pyrano[2,3-c]pyrazol-1-yl)benzoate Openeye Name: isopentyl 4-[6-amino-5-cyano-3-methyl-4-(3-pyridyl)-4H-pyrano[2,3-c]pyrazol-1-yl]benzoate CAS Name: 4-[6-amino-5-cyano-3-methyl-4-(3-pyridinyl)-4H-pyrano[2,3-c]pyrazol-1-yl]benzoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 4-(6-amino-5-cyano-3-methyl-4-pyridin-3-yl-4H-pyrano[2,3-c]pyrazol-1-yl)benzoate Traditional Name: 4-[6-amino-5-cyano-3-methyl-4-(3-pyridyl)-4H-pyrano[2,3-c]pyrazol-1-yl]benzoic acid isoamyl ester Formula: C25H25N5O3 MolecularWeight: 443.4977

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CN=CC=C3)C4=CC=C(C=C4)C(=O)OCCC(C)C

Isomeric SMILES

CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CN=CC=C3)C4=CC=C(C=C4)C(=O)OCCC(C)C

InChI

InChI=1S/C25H25N5O3/c1-15(2)10-12-32-25(31)17-6-8-19(9-7-17)30-24-21(16(3)29-30)22(18-5-4-11-28-14-18)20(13-26)23(27)33-24/h4-9,11,14-15,22H,10,12,27H2,1-3H3