(2S)-1-[4-[5-methoxy-2-methyl-4-[[4-[(2-propan-2-ylsulfonylphenyl)amino]pyrazolo[1,5-a][1,3,5]triazin-2-yl]amino]phenyl]piperidin-1-yl]-2-(propan-2-ylamino)propan-1-one

Systemtic Name: (2S)-1-[4-[5-methoxy-2-methyl-4-[[4-[(2-propan-2-ylsulfonylphenyl)amino]pyrazolo[1,5-a][1,3,5]triazin-2-yl]amino]phenyl]piperidin-1-yl]-2-(propan-2-ylamino)propan-1-one Openeye Name: (2S)-2-(isopropylamino)-1-[4-[4-[[4-(2-isopropylsulfonylanilino)pyrazolo[1,5-a][1,3,5]triazin-2-yl]amino]-5-methoxy-2-methyl-phenyl]-1-piperidyl]propan-1-one CAS Name: (2S)-1-[4-[5-methoxy-2-methyl-4-[[4-(2-propan-2-ylsulfonylanilino)-2-pyrazolo[1,5-a][1,3,5]triazinyl]amino]phenyl]-1-piperidinyl]-2-(propan-2-ylamino)-1-propanone IUPAC Name: (2S)-1-[4-[5-methoxy-2-methyl-4-[[4-(2-propan-2-ylsulfonylanilino)pyrazolo[1,5-a][1,3,5]triazin-2-yl]amino]phenyl]piperidin-1-yl]-2-(propan-2-ylamino)propan-1-one Traditional Name: (2S)-2-(isopropylamino)-1-[4-[4-[[4-(2-isopropylsulfonylanilino)pyrazolo[1,5-a][1,3,5]triazin-2-yl]amino]-5-methoxy-2-methyl-phenyl]piperidino]propan-1-one Formula: C33H44N8O4S MolecularWeight: 648.81866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2CCN(CC2)C(=O)C(C)NC(C)C)OC)NC3=NC4=CC=NN4C(=N3)NC5=CC=CC=C5S(=O)(=O)C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1C2CCN(CC2)C(=O)[C@H](C)NC(C)C)OC)NC3=NC4=CC=NN4C(=N3)NC5=CC=CC=C5S(=O)(=O)C(C)C

InChI

InChI=1S/C33H44N8O4S/c1-20(2)35-23(6)31(42)40-16-13-24(14-17-40)25-19-28(45-7)27(18-22(25)5)36-32-38-30-12-15-34-41(30)33(39-32)37-26-10-8-9-11-29(26)46(43,44)21(3)4/h8-12,15,18-21,23-24,35H,13-14,16-17H2,1-7H3,(H2,36,37,38,39)/t23-/m0/s1