2-[(4R)-6-azanyl-5-cyano-3-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl]benzoate

Systemtic Name: 2-[(4R)-6-azanyl-5-cyano-3-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl]benzoate Openeye Name: 2-[(4R)-6-amino-5-cyano-3-(2-thienyl)-2,4-dihydropyrano[2,3-c]pyrazol-4-yl]benzoate CAS Name: 2-[(4R)-6-amino-5-cyano-3-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl]benzoate IUPAC Name: 2-[(4R)-6-amino-5-cyano-3-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl]benzoate Traditional Name: 2-[(4R)-6-amino-5-cyano-3-(2-thienyl)-2,4-dihydropyrano[2,3-c]pyrazol-4-yl]benzoate Formula: C18H11N4O3S- MolecularWeight: 363.36994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2C(=C(OC3=NNC(=C23)C4=CC=CS4)N)C#N)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)[C@@H]2C(=C(OC3=NNC(=C23)C4=CC=CS4)N)C#N)C(=O)[O-]

InChI

InChI=1S/C18H12N4O3S/c19-8-11-13(9-4-1-2-5-10(9)18(23)24)14-15(12-6-3-7-26-12)21-22-17(14)25-16(11)20/h1-7,13H,20H2,(H,21,22)(H,23,24)/p-1/t13-/m1/s1