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

Systemtic Name: 4,6-dimethyl-N-(phenylmethyl)-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: N-benzyl-4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: 4,6-dimethyl-N-(phenylmethyl)-3-(1-pyrrolyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: N-benzyl-4,6-dimethyl-3-pyrrol-1-ylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: N-benzyl-4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide Formula: C21H19N3OS MolecularWeight: 361.46006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=C(S2)C(=O)NCC3=CC=CC=C3)N4C=CC=C4)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(S2)C(=O)NCC3=CC=CC=C3)N4C=CC=C4)C

InChI

InChI=1S/C21H19N3OS/c1-14-12-15(2)23-21-17(14)18(24-10-6-7-11-24)19(26-21)20(25)22-13-16-8-4-3-5-9-16/h3-12H,13H2,1-2H3,(H,22,25)