(3E)-3-[(quinolin-6-ylamino)methylidene]-5-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridin-2-one

Systemtic Name: (3E)-3-[(quinolin-6-ylamino)methylidene]-5-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridin-2-one Openeye Name: (3E)-3-[(6-quinolylamino)methylene]-5-(3-thienyl)-1H-pyrrolo[2,3-b]pyridin-2-one CAS Name: (3E)-3-[(6-quinolinylamino)methylidene]-5-(3-thiophenyl)-1H-pyrrolo[2,3-b]pyridin-2-one IUPAC Name: (3E)-3-[(quinolin-6-ylamino)methylidene]-5-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridin-2-one Traditional Name: (3E)-3-[(6-quinolylamino)methylene]-5-(3-thienyl)-1H-pyrrolo[2,3-b]pyridin-2-one Formula: C21H14N4OS MolecularWeight: 370.42706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)NC=C3C4=C(NC3=O)N=CC(=C4)C5=CSC=C5)N=C1

Isomeric SMILES

C1=CC2=C(C=CC(=C2)N/C=C/3\C4=C(NC3=O)N=CC(=C4)C5=CSC=C5)N=C1

InChI

InChI=1S/C21H14N4OS/c26-21-18(11-23-16-3-4-19-13(8-16)2-1-6-22-19)17-9-15(10-24-20(17)25-21)14-5-7-27-12-14/h1-12,23H,(H,24,25,26)/b18-11+