3-(2-hydroxyethyliminomethylamino)-4-methyl-6-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid

Systemtic Name: 3-(2-hydroxyethyliminomethylamino)-4-methyl-6-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid Openeye Name: 3-(2-hydroxyethyliminomethylamino)-4-methyl-6-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid CAS Name: 3-(2-hydroxyethyliminomethylamino)-4-methyl-6-phenyl-2-thieno[2,3-b]pyridinecarboxylic acid IUPAC Name: 3-(2-hydroxyethyliminomethylamino)-4-methyl-6-phenylthieno[2,3-b]pyridine-2-carboxylic acid Traditional Name: 3-(2-hydroxyethyliminomethylamino)-4-methyl-6-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=C(S2)C(=O)O)NC=NCCO)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(S2)C(=O)O)NC=NCCO)C3=CC=CC=C3

InChI

InChI=1S/C18H17N3O3S/c1-11-9-13(12-5-3-2-4-6-12)21-17-14(11)15(16(25-17)18(23)24)20-10-19-7-8-22/h2-6,9-10,22H,7-8H2,1H3,(H,19,20)(H,23,24)