3-azanyl-6-oxidanylidene-2-[(4-propan-2-ylphenyl)carbamoyl]-7H-thieno[2,3-b]pyridine-5-carboxylate

Systemtic Name: 3-azanyl-6-oxidanylidene-2-[(4-propan-2-ylphenyl)carbamoyl]-7H-thieno[2,3-b]pyridine-5-carboxylate Openeye Name: 3-amino-2-[(4-isopropylphenyl)carbamoyl]-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylate CAS Name: 3-amino-6-oxo-2-[oxo-(4-propan-2-ylanilino)methyl]-7H-thieno[2,3-b]pyridine-5-carboxylate IUPAC Name: 3-amino-6-oxo-2-[(4-propan-2-ylphenyl)carbamoyl]-7H-thieno[2,3-b]pyridine-5-carboxylate Traditional Name: 3-amino-6-keto-2-(p-cumenylcarbamoyl)-7H-thieno[2,3-b]pyridine-5-carboxylate Formula: C18H16N3O4S- MolecularWeight: 370.40234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)NC(=O)C(=C3)C(=O)[O-])N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)NC(=O)C(=C3)C(=O)[O-])N

InChI

InChI=1S/C18H17N3O4S/c1-8(2)9-3-5-10(6-4-9)20-16(23)14-13(19)11-7-12(18(24)25)15(22)21-17(11)26-14/h3-8H,19H2,1-2H3,(H,20,23)(H,21,22)(H,24,25)/p-1