1-[[1-(1-benzothiophen-2-yl)-2-methyl-propan-2-yl]amino]-3-[5-bromanyl-2-(2-propan-2-ylidenehydrazinyl)pyrimidin-4-yl]oxy-propan-2-ol

Systemtic Name: 1-[[1-(1-benzothiophen-2-yl)-2-methyl-propan-2-yl]amino]-3-[5-bromanyl-2-(2-propan-2-ylidenehydrazinyl)pyrimidin-4-yl]oxy-propan-2-ol Openeye Name: 1-[[2-(benzothiophen-2-yl)-1,1-dimethyl-ethyl]amino]-3-[5-bromo-2-(2-isopropylidenehydrazino)pyrimidin-4-yl]oxy-propan-2-ol CAS Name: 1-[[1-(1-benzothiophen-2-yl)-2-methylpropan-2-yl]amino]-3-[[5-bromo-2-(2-propan-2-ylidenehydrazinyl)-4-pyrimidinyl]oxy]-2-propanol IUPAC Name: 1-[[1-(1-benzothiophen-2-yl)-2-methylpropan-2-yl]amino]-3-[5-bromo-2-(2-propan-2-ylidenehydrazinyl)pyrimidin-4-yl]oxypropan-2-ol Traditional Name: 1-[[2-(benzothiophen-2-yl)-1,1-dimethyl-ethyl]amino]-3-[5-bromo-2-(N'-isopropylidenehydrazino)pyrimidin-4-yl]oxy-propan-2-ol Formula: C22H28BrN5O2S MolecularWeight: 506.45902

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=NC=C(C(=N1)OCC(CNC(C)(C)CC2=CC3=CC=CC=C3S2)O)Br)C

Isomeric SMILES

CC(=NNC1=NC=C(C(=N1)OCC(CNC(C)(C)CC2=CC3=CC=CC=C3S2)O)Br)C

InChI

InChI=1S/C22H28BrN5O2S/c1-14(2)27-28-21-24-12-18(23)20(26-21)30-13-16(29)11-25-22(3,4)10-17-9-15-7-5-6-8-19(15)31-17/h5-9,12,16,25,29H,10-11,13H2,1-4H3,(H,24,26,28)