1-(1-methylpiperazin-2-yl)-2-[4-[(4-thiophen-2-ylpyrimidin-2-yl)amino]phenoxy]ethanone

Systemtic Name: 1-(1-methylpiperazin-2-yl)-2-[4-[(4-thiophen-2-ylpyrimidin-2-yl)amino]phenoxy]ethanone Openeye Name: 1-(1-methylpiperazin-2-yl)-2-[4-[[4-(2-thienyl)pyrimidin-2-yl]amino]phenoxy]ethanone CAS Name: 1-(1-methyl-2-piperazinyl)-2-[4-[(4-thiophen-2-yl-2-pyrimidinyl)amino]phenoxy]ethanone IUPAC Name: 1-(1-methylpiperazin-2-yl)-2-[4-[(4-thiophen-2-ylpyrimidin-2-yl)amino]phenoxy]ethanone Traditional Name: 1-(1-methylpiperazin-2-yl)-2-[4-[[4-(2-thienyl)pyrimidin-2-yl]amino]phenoxy]ethanone Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCNCC1C(=O)COC2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC=CS4

Isomeric SMILES

CN1CCNCC1C(=O)COC2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC=CS4

InChI

InChI=1S/C21H23N5O2S/c1-26-11-10-22-13-18(26)19(27)14-28-16-6-4-15(5-7-16)24-21-23-9-8-17(25-21)20-3-2-12-29-20/h2-9,12,18,22H,10-11,13-14H2,1H3,(H,23,24,25)