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

Systemtic Name: N-[(4-propan-2-yloxyphenyl)methyl]-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: N-[(4-isopropoxyphenyl)methyl]-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: N-[(4-propan-2-yloxyphenyl)methyl]-3-(1-pyrrolyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: N-[(4-propan-2-yloxyphenyl)methyl]-3-pyrrol-1-ylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: N-(4-isopropoxybenzyl)-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CNC(=O)C2=C(C3=C(S2)N=CC=C3)N4C=CC=C4

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CNC(=O)C2=C(C3=C(S2)N=CC=C3)N4C=CC=C4

InChI

InChI=1S/C22H21N3O2S/c1-15(2)27-17-9-7-16(8-10-17)14-24-21(26)20-19(25-12-3-4-13-25)18-6-5-11-23-22(18)28-20/h3-13,15H,14H2,1-2H3,(H,24,26)