1-[3,3-dimethyl-6-[[4-(quinolin-6-ylamino)pyrimidin-2-yl]amino]-2H-indol-1-yl]ethanone

Systemtic Name: 1-[3,3-dimethyl-6-[[4-(quinolin-6-ylamino)pyrimidin-2-yl]amino]-2H-indol-1-yl]ethanone Openeye Name: 1-[3,3-dimethyl-6-[[4-(6-quinolylamino)pyrimidin-2-yl]amino]indolin-1-yl]ethanone CAS Name: 1-[3,3-dimethyl-6-[[4-(6-quinolinylamino)-2-pyrimidinyl]amino]-2H-indol-1-yl]ethanone IUPAC Name: 1-[3,3-dimethyl-6-[[4-(quinolin-6-ylamino)pyrimidin-2-yl]amino]-2H-indol-1-yl]ethanone Traditional Name: 1-[3,3-dimethyl-6-[[4-(6-quinolylamino)pyrimidin-2-yl]amino]indolin-1-yl]ethanone Formula: C25H24N6O MolecularWeight: 424.49766

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(C2=C1C=C(C=C2)NC3=NC=CC(=N3)NC4=CC5=C(C=C4)N=CC=C5)(C)C

Isomeric SMILES

CC(=O)N1CC(C2=C1C=C(C=C2)NC3=NC=CC(=N3)NC4=CC5=C(C=C4)N=CC=C5)(C)C

InChI

InChI=1S/C25H24N6O/c1-16(32)31-15-25(2,3)20-8-6-19(14-22(20)31)29-24-27-12-10-23(30-24)28-18-7-9-21-17(13-18)5-4-11-26-21/h4-14H,15H2,1-3H3,(H2,27,28,29,30)