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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=C(C=C1)N2C3=C(C(C(=C(O3)N)C#N)C4=CC=NC=C4)C(=N2)C

Isomeric SMILES

CCCCCOC(=O)C1=CC=C(C=C1)N2C3=C(C(C(=C(O3)N)C#N)C4=CC=NC=C4)C(=N2)C

InChI

InChI=1S/C25H25N5O3/c1-3-4-5-14-32-25(31)18-6-8-19(9-7-18)30-24-21(16(2)29-30)22(17-10-12-28-13-11-17)20(15-26)23(27)33-24/h6-13,22H,3-5,14,27H2,1-2H3