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

Systemtic Name: 3-azanyl-4-(4-dimethylaminophenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid Openeye Name: 3-amino-4-(4-dimethylaminophenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid CAS Name: 3-amino-4-(4-dimethylaminophenyl)-6-phenyl-2-thieno[2,3-b]pyridinecarboxylic acid IUPAC Name: 3-amino-4-(4-dimethylaminophenyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylic acid Traditional Name: 3-amino-4-(4-dimethylaminophenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid Formula: C22H19N3O2S MolecularWeight: 389.47016

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=CC(=NC3=C2C(=C(S3)C(=O)O)N)C4=CC=CC=C4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=CC(=NC3=C2C(=C(S3)C(=O)O)N)C4=CC=CC=C4

InChI

InChI=1S/C22H19N3O2S/c1-25(2)15-10-8-13(9-11-15)16-12-17(14-6-4-3-5-7-14)24-21-18(16)19(23)20(28-21)22(26)27/h3-12H,23H2,1-2H3,(H,26,27)