3-azanyl-4-(1,3-benzodioxol-5-yl)-N,6-diphenyl-thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-4-(1,3-benzodioxol-5-yl)-N,6-diphenyl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-4-(1,3-benzodioxol-5-yl)-N,6-diphenyl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-4-(1,3-benzodioxol-5-yl)-N,6-diphenyl-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-4-(1,3-benzodioxol-5-yl)-N,6-diphenylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-4-(1,3-benzodioxol-5-yl)-N,6-diphenyl-thieno[2,3-b]pyridine-2-carboxamide Formula: C27H19N3O3S MolecularWeight: 465.52306

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC(=NC4=C3C(=C(S4)C(=O)NC5=CC=CC=C5)N)C6=CC=CC=C6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC(=NC4=C3C(=C(S4)C(=O)NC5=CC=CC=C5)N)C6=CC=CC=C6

InChI

InChI=1S/C27H19N3O3S/c28-24-23-19(17-11-12-21-22(13-17)33-15-32-21)14-20(16-7-3-1-4-8-16)30-27(23)34-25(24)26(31)29-18-9-5-2-6-10-18/h1-14H,15,28H2,(H,29,31)