3-[[N-(2-hydroxyethyl)-C-methyl-carbonimidoyl]amino]-4-methyl-6-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid

Systemtic Name: 3-[[N-(2-hydroxyethyl)-C-methyl-carbonimidoyl]amino]-4-methyl-6-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid Openeye Name: 3-[[N-(2-hydroxyethyl)-C-methyl-carbonimidoyl]amino]-4-methyl-6-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid CAS Name: 3-[1-(2-hydroxyethylimino)ethylamino]-4-methyl-6-phenyl-2-thieno[2,3-b]pyridinecarboxylic acid IUPAC Name: 3-[[N-(2-hydroxyethyl)-C-methylcarbonimidoyl]amino]-4-methyl-6-phenylthieno[2,3-b]pyridine-2-carboxylic acid Traditional Name: 3-[[N-(2-hydroxyethyl)-C-methyl-carbonimidoyl]amino]-4-methyl-6-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O3S/c1-11-10-14(13-6-4-3-5-7-13)22-18-15(11)16(17(26-18)19(24)25)21-12(2)20-8-9-23/h3-7,10,23H,8-9H2,1-2H3,(H,20,21)(H,24,25)