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

Systemtic Name: 4,6-dimethyl-N-phenethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 4,6-dimethyl-N-phenethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: 4,6-dimethyl-N-phenethyl-3-(1-pyrrolyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 4,6-dimethyl-N-phenethyl-3-pyrrol-1-ylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: 4,6-dimethyl-N-phenethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide Formula: C22H21N3OS MolecularWeight: 375.48664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=C(S2)C(=O)NCCC3=CC=CC=C3)N4C=CC=C4)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(S2)C(=O)NCCC3=CC=CC=C3)N4C=CC=C4)C

InChI

InChI=1S/C22H21N3OS/c1-15-14-16(2)24-22-18(15)19(25-12-6-7-13-25)20(27-22)21(26)23-11-10-17-8-4-3-5-9-17/h3-9,12-14H,10-11H2,1-2H3,(H,23,26)