3-azanyl-4-(furan-2-yl)-6-methyl-5-(phenylcarbamoyl)-4,7-dihydrothieno[2,3-b]pyridine-2-carboxylic acid

Systemtic Name: 3-azanyl-4-(furan-2-yl)-6-methyl-5-(phenylcarbamoyl)-4,7-dihydrothieno[2,3-b]pyridine-2-carboxylic acid Openeye Name: 3-amino-4-(2-furyl)-6-methyl-5-(phenylcarbamoyl)-4,7-dihydrothieno[2,3-b]pyridine-2-carboxylic acid CAS Name: 3-amino-5-[anilino(oxo)methyl]-4-(2-furanyl)-6-methyl-4,7-dihydrothieno[2,3-b]pyridine-2-carboxylic acid IUPAC Name: 3-amino-4-(furan-2-yl)-6-methyl-5-(phenylcarbamoyl)-4,7-dihydrothieno[2,3-b]pyridine-2-carboxylic acid Traditional Name: 3-amino-4-(2-furyl)-6-methyl-5-(phenylcarbamoyl)-4,7-dihydrothieno[2,3-b]pyridine-2-carboxylic acid Formula: C20H17N3O4S MolecularWeight: 395.43168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)SC(=C2N)C(=O)O)C3=CC=CO3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(C2=C(N1)SC(=C2N)C(=O)O)C3=CC=CO3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C20H17N3O4S/c1-10-13(18(24)23-11-6-3-2-4-7-11)14(12-8-5-9-27-12)15-16(21)17(20(25)26)28-19(15)22-10/h2-9,14,22H,21H2,1H3,(H,23,24)(H,25,26)