N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-1-piperazin-1-yl-2,3-dihydro-1H-indene-5-carboxamide

Systemtic Name: N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-1-piperazin-1-yl-2,3-dihydro-1H-indene-5-carboxamide Openeye Name: N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]-1-piperazin-1-yl-indane-5-carboxamide CAS Name: N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]-1-(1-piperazinyl)-2,3-dihydro-1H-indene-5-carboxamide IUPAC Name: N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-1-piperazin-1-yl-2,3-dihydro-1H-indene-5-carboxamide Traditional Name: N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]-1-piperazino-indane-5-carboxamide Formula: C30H31N7O MolecularWeight: 505.61344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(CC3)N4CCNCC4)NC5=NC=CC(=N5)C6=CN=CC=C6

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(CC3)N4CCNCC4)NC5=NC=CC(=N5)C6=CN=CC=C6

InChI

InChI=1S/C30H31N7O/c1-20-4-7-24(18-27(20)36-30-33-12-10-26(35-30)23-3-2-11-32-19-23)34-29(38)22-5-8-25-21(17-22)6-9-28(25)37-15-13-31-14-16-37/h2-5,7-8,10-12,17-19,28,31H,6,9,13-16H2,1H3,(H,34,38)(H,33,35,36)