3-(2,5-dimethylpyrrol-1-yl)-N-[(2-methylphenyl)methyl]thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-(2,5-dimethylpyrrol-1-yl)-N-[(2-methylphenyl)methyl]thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-(2,5-dimethylpyrrol-1-yl)-N-(o-tolylmethyl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-(2,5-dimethyl-1-pyrrolyl)-N-[(2-methylphenyl)methyl]-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-(2,5-dimethylpyrrol-1-yl)-N-[(2-methylphenyl)methyl]thieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-(2,5-dimethylpyrrol-1-yl)-N-(2-methylbenzyl)thieno[2,3-b]pyridine-2-carboxamide Formula: C22H21N3OS MolecularWeight: 375.48664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)C2=C(C3=C(S2)N=CC=C3)N4C(=CC=C4C)C

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)C2=C(C3=C(S2)N=CC=C3)N4C(=CC=C4C)C

InChI

InChI=1S/C22H21N3OS/c1-14-7-4-5-8-17(14)13-24-21(26)20-19(25-15(2)10-11-16(25)3)18-9-6-12-23-22(18)27-20/h4-12H,13H2,1-3H3,(H,24,26)