1-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-3-oxidanylidene-4H-quinoxalin-6-yl]-3-octyl-urea

Systemtic Name: 1-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-3-oxidanylidene-4H-quinoxalin-6-yl]-3-octyl-urea Openeye Name: 1-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-3-oxo-4H-quinoxalin-6-yl]-3-octyl-urea CAS Name: 1-[2-(1-methyl-3-pyrrolo[2,3-b]pyridinyl)-3-oxo-4H-quinoxalin-6-yl]-3-octylurea IUPAC Name: 1-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-3-oxo-4H-quinoxalin-6-yl]-3-octylurea Traditional Name: 1-[3-keto-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-4H-quinoxalin-6-yl]-3-octyl-urea Formula: C25H30N6O2 MolecularWeight: 446.5447

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)NC1=CC2=C(C=C1)N=C(C(=O)N2)C3=CN(C4=C3C=CC=N4)C

Isomeric SMILES

CCCCCCCCNC(=O)NC1=CC2=C(C=C1)N=C(C(=O)N2)C3=CN(C4=C3C=CC=N4)C

InChI

InChI=1S/C25H30N6O2/c1-3-4-5-6-7-8-13-27-25(33)28-17-11-12-20-21(15-17)30-24(32)22(29-20)19-16-31(2)23-18(19)10-9-14-26-23/h9-12,14-16H,3-8,13H2,1-2H3,(H,30,32)(H2,27,28,33)