3-azanyl-N-(1,3-benzodioxol-5-yl)-6-butyl-thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-N-(1,3-benzodioxol-5-yl)-6-butyl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-N-(1,3-benzodioxol-5-yl)-6-butyl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-N-(1,3-benzodioxol-5-yl)-6-butyl-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-N-(1,3-benzodioxol-5-yl)-6-butylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-N-(1,3-benzodioxol-5-yl)-6-butyl-thieno[2,3-b]pyridine-2-carboxamide Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C=C1)C(=C(S2)C(=O)NC3=CC4=C(C=C3)OCO4)N

Isomeric SMILES

CCCCC1=NC2=C(C=C1)C(=C(S2)C(=O)NC3=CC4=C(C=C3)OCO4)N

InChI

InChI=1S/C19H19N3O3S/c1-2-3-4-11-5-7-13-16(20)17(26-19(13)22-11)18(23)21-12-6-8-14-15(9-12)25-10-24-14/h5-9H,2-4,10,20H2,1H3,(H,21,23)