2,2-dimethyl-1-[2-[(3-piperazin-1-ylphenyl)amino]-5H-pyrrolo[2,3-b]pyrazin-7-yl]propan-1-one

Systemtic Name: 2,2-dimethyl-1-[2-[(3-piperazin-1-ylphenyl)amino]-5H-pyrrolo[2,3-b]pyrazin-7-yl]propan-1-one Openeye Name: 2,2-dimethyl-1-[2-(3-piperazin-1-ylanilino)-5H-pyrrolo[2,3-b]pyrazin-7-yl]propan-1-one CAS Name: 2,2-dimethyl-1-[2-[3-(1-piperazinyl)anilino]-5H-pyrrolo[2,3-b]pyrazin-7-yl]-1-propanone IUPAC Name: 2,2-dimethyl-1-[2-(3-piperazin-1-ylanilino)-5H-pyrrolo[2,3-b]pyrazin-7-yl]propan-1-one Traditional Name: 2,2-dimethyl-1-[2-(3-piperazinoanilino)-5H-pyrrolo[2,3-b]pyrazin-7-yl]propan-1-one Formula: C21H26N6O MolecularWeight: 378.47074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C1=CNC2=NC=C(N=C12)NC3=CC=CC(=C3)N4CCNCC4

Isomeric SMILES

CC(C)(C)C(=O)C1=CNC2=NC=C(N=C12)NC3=CC=CC(=C3)N4CCNCC4

InChI

InChI=1S/C21H26N6O/c1-21(2,3)19(28)16-12-23-20-18(16)26-17(13-24-20)25-14-5-4-6-15(11-14)27-9-7-22-8-10-27/h4-6,11-13,22H,7-10H2,1-3H3,(H,23,24)(H,25,26)