3-azanyl-4,6-diphenyl-thieno[2,3-b]pyridine-2-carboxylic acid; 1,4-dioxane

Systemtic Name: 3-azanyl-4,6-diphenyl-thieno[2,3-b]pyridine-2-carboxylic acid; 1,4-dioxane Openeye Name: 3-amino-4,6-diphenyl-thieno[2,3-b]pyridine-2-carboxylic acid; 1,4-dioxane CAS Name: 3-amino-4,6-diphenyl-2-thieno[2,3-b]pyridinecarboxylic acid; 1,4-dioxane IUPAC Name: 3-amino-4,6-diphenylthieno[2,3-b]pyridine-2-carboxylic acid; 1,4-dioxane Traditional Name: 3-amino-4,6-diphenyl-thieno[2,3-b]pyridine-2-carboxylic acid; 1,4-dioxane Formula: C24H22N2O4S MolecularWeight: 434.50748

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCO1.C1=CC=C(C=C1)C2=CC(=NC3=C2C(=C(S3)C(=O)O)N)C4=CC=CC=C4

Isomeric SMILES

C1COCCO1.C1=CC=C(C=C1)C2=CC(=NC3=C2C(=C(S3)C(=O)O)N)C4=CC=CC=C4

InChI

InChI=1S/C20H14N2O2S.C4H8O2/c21-17-16-14(12-7-3-1-4-8-12)11-15(13-9-5-2-6-10-13)22-19(16)25-18(17)20(23)24;1-2-6-4-3-5-1/h1-11H,21H2,(H,23,24);1-4H2