4-[(6-methyl-1H-indol-5-yl)amino]-5-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]pyridine-3-carbonitrile

Systemtic Name: 4-[(6-methyl-1H-indol-5-yl)amino]-5-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]pyridine-3-carbonitrile Openeye Name: 4-[(6-methyl-1H-indol-5-yl)amino]-5-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]pyridine-3-carbonitrile CAS Name: 4-[(6-methyl-1H-indol-5-yl)amino]-5-[4-[2-(4-methyl-1-piperazinyl)ethoxy]phenyl]-3-pyridinecarbonitrile IUPAC Name: 4-[(6-methyl-1H-indol-5-yl)amino]-5-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]pyridine-3-carbonitrile Traditional Name: 4-[(6-methyl-1H-indol-5-yl)amino]-5-[4-[2-(4-methylpiperazino)ethoxy]phenyl]nicotinonitrile Formula: C28H30N6O MolecularWeight: 466.5774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CNC2=C1)NC3=C(C=NC=C3C#N)C4=CC=C(C=C4)OCCN5CCN(CC5)C

Isomeric SMILES

CC1=C(C=C2C=CNC2=C1)NC3=C(C=NC=C3C#N)C4=CC=C(C=C4)OCCN5CCN(CC5)C

InChI

InChI=1S/C28H30N6O/c1-20-15-27-22(7-8-31-27)16-26(20)32-28-23(17-29)18-30-19-25(28)21-3-5-24(6-4-21)35-14-13-34-11-9-33(2)10-12-34/h3-8,15-16,18-19,31H,9-14H2,1-2H3,(H,30,32)