N-[2-(3,4-diethoxyphenyl)ethyl]-4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4,6-dimethyl-3-(1-pyrrolyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4,6-dimethyl-3-pyrrol-1-ylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide Formula: C26H29N3O3S MolecularWeight: 463.59176

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C2=C(C3=C(S2)N=C(C=C3C)C)N4C=CC=C4)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)C2=C(C3=C(S2)N=C(C=C3C)C)N4C=CC=C4)OCC

InChI

InChI=1S/C26H29N3O3S/c1-5-31-20-10-9-19(16-21(20)32-6-2)11-12-27-25(30)24-23(29-13-7-8-14-29)22-17(3)15-18(4)28-26(22)33-24/h7-10,13-16H,5-6,11-12H2,1-4H3,(H,27,30)