3-pyrrol-1-yl-N-[(3,4,5-triethoxyphenyl)methyl]thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-pyrrol-1-yl-N-[(3,4,5-triethoxyphenyl)methyl]thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-pyrrol-1-yl-N-[(3,4,5-triethoxyphenyl)methyl]thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-(1-pyrrolyl)-N-[(3,4,5-triethoxyphenyl)methyl]-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-pyrrol-1-yl-N-[(3,4,5-triethoxyphenyl)methyl]thieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-pyrrol-1-yl-N-(3,4,5-triethoxybenzyl)thieno[2,3-b]pyridine-2-carboxamide Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)CNC(=O)C2=C(C3=C(S2)N=CC=C3)N4C=CC=C4

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)CNC(=O)C2=C(C3=C(S2)N=CC=C3)N4C=CC=C4

InChI

InChI=1S/C25H27N3O4S/c1-4-30-19-14-17(15-20(31-5-2)22(19)32-6-3)16-27-24(29)23-21(28-12-7-8-13-28)18-10-9-11-26-25(18)33-23/h7-15H,4-6,16H2,1-3H3,(H,27,29)