1-(4-methylpiperazin-1-yl)-2-[6-[(4-methyl-1,3-thiazol-2-yl)amino]-5-phenylmethoxy-pyridin-3-yl]sulfanyl-ethanone

Systemtic Name: 1-(4-methylpiperazin-1-yl)-2-[6-[(4-methyl-1,3-thiazol-2-yl)amino]-5-phenylmethoxy-pyridin-3-yl]sulfanyl-ethanone Openeye Name: 2-[[5-benzyloxy-6-[(4-methylthiazol-2-yl)amino]-3-pyridyl]sulfanyl]-1-(4-methylpiperazin-1-yl)ethanone CAS Name: 1-(4-methyl-1-piperazinyl)-2-[[6-[(4-methyl-2-thiazolyl)amino]-5-phenylmethoxy-3-pyridinyl]thio]ethanone IUPAC Name: 1-(4-methylpiperazin-1-yl)-2-[6-[(4-methyl-1,3-thiazol-2-yl)amino]-5-phenylmethoxypyridin-3-yl]sulfanylethanone Traditional Name: 2-[[5-benzoxy-6-[(4-methylthiazol-2-yl)amino]-3-pyridyl]thio]-1-(4-methylpiperazino)ethanone Formula: C23H27N5O2S2 MolecularWeight: 469.62278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC2=NC=C(C=C2OCC3=CC=CC=C3)SCC(=O)N4CCN(CC4)C

Isomeric SMILES

CC1=CSC(=N1)NC2=NC=C(C=C2OCC3=CC=CC=C3)SCC(=O)N4CCN(CC4)C

InChI

InChI=1S/C23H27N5O2S2/c1-17-15-32-23(25-17)26-22-20(30-14-18-6-4-3-5-7-18)12-19(13-24-22)31-16-21(29)28-10-8-27(2)9-11-28/h3-7,12-13,15H,8-11,14,16H2,1-2H3,(H,24,25,26)