sodium 4-oxidanylidene-5-(3-piperidin-1-ylpropylcarbamoyl)-7-propan-2-yl-thieno[2,3-b]pyridin-6-olate

Systemtic Name: sodium 4-oxidanylidene-5-(3-piperidin-1-ylpropylcarbamoyl)-7-propan-2-yl-thieno[2,3-b]pyridin-6-olate Openeye Name: sodium 7-isopropyl-4-oxo-5-[3-(1-piperidyl)propylcarbamoyl]thieno[2,3-b]pyridin-6-olate CAS Name: sodium 4-oxo-5-[oxo-[3-(1-piperidinyl)propylamino]methyl]-7-propan-2-yl-6-thieno[2,3-b]pyridinolate IUPAC Name: sodium 4-oxo-5-(3-piperidin-1-ylpropylcarbamoyl)-7-propan-2-ylthieno[2,3-b]pyridin-6-olate Traditional Name: sodium 7-isopropyl-4-keto-5-(3-piperidinopropylcarbamoyl)thieno[2,3-b]pyridin-6-olate Formula: C19H26N3NaO3S MolecularWeight: 399.48281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=C(C(=O)C2=C1SC=C2)C(=O)NCCCN3CCCCC3)[O-].[Na+]

Isomeric SMILES

CC(C)N1C(=C(C(=O)C2=C1SC=C2)C(=O)NCCCN3CCCCC3)[O-].[Na+]

InChI

InChI=1S/C19H27N3O3S.Na/c1-13(2)22-18(25)15(16(23)14-7-12-26-19(14)22)17(24)20-8-6-11-21-9-4-3-5-10-21;/h7,12-13,25H,3-6,8-11H2,1-2H3,(H,20,24);/q;+1/p-1