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

Systemtic Name: N-(2-chloroethyl)-4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: N-(2-chloroethyl)-4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: N-(2-chloroethyl)-4,6-dimethyl-3-(1-pyrrolyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: N-(2-chloroethyl)-4,6-dimethyl-3-pyrrol-1-ylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: N-(2-chloroethyl)-4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide Formula: C16H16ClN3OS MolecularWeight: 333.83574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=C(S2)C(=O)NCCCl)N3C=CC=C3)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(S2)C(=O)NCCCl)N3C=CC=C3)C

InChI

InChI=1S/C16H16ClN3OS/c1-10-9-11(2)19-16-12(10)13(20-7-3-4-8-20)14(22-16)15(21)18-6-5-17/h3-4,7-9H,5-6H2,1-2H3,(H,18,21)