2-[3-[(2,6-dimethylphenyl)amino]-6-phenylazanyl-indazol-1-yl]-1-(4-methylpiperazin-1-yl)ethanone

Systemtic Name: 2-[3-[(2,6-dimethylphenyl)amino]-6-phenylazanyl-indazol-1-yl]-1-(4-methylpiperazin-1-yl)ethanone Openeye Name: 2-[6-anilino-3-(2,6-dimethylanilino)indazol-1-yl]-1-(4-methylpiperazin-1-yl)ethanone CAS Name: 2-[6-anilino-3-(2,6-dimethylanilino)-1-indazolyl]-1-(4-methyl-1-piperazinyl)ethanone IUPAC Name: 2-[6-anilino-3-(2,6-dimethylanilino)indazol-1-yl]-1-(4-methylpiperazin-1-yl)ethanone Traditional Name: 2-[6-anilino-3-(2,6-dimethylanilino)indazol-1-yl]-1-(4-methylpiperazino)ethanone Formula: C28H32N6O MolecularWeight: 468.59328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC2=NN(C3=C2C=CC(=C3)NC4=CC=CC=C4)CC(=O)N5CCN(CC5)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC2=NN(C3=C2C=CC(=C3)NC4=CC=CC=C4)CC(=O)N5CCN(CC5)C

InChI

InChI=1S/C28H32N6O/c1-20-8-7-9-21(2)27(20)30-28-24-13-12-23(29-22-10-5-4-6-11-22)18-25(24)34(31-28)19-26(35)33-16-14-32(3)15-17-33/h4-13,18,29H,14-17,19H2,1-3H3,(H,30,31)