N-[3-[3-(4-ethylpiperazin-1-yl)propoxy]phenyl]-4-(1,3-thiazol-2-yl)pyrimidin-2-amine

Systemtic Name: N-[3-[3-(4-ethylpiperazin-1-yl)propoxy]phenyl]-4-(1,3-thiazol-2-yl)pyrimidin-2-amine Openeye Name: N-[3-[3-(4-ethylpiperazin-1-yl)propoxy]phenyl]-4-thiazol-2-yl-pyrimidin-2-amine CAS Name: N-[3-[3-(4-ethyl-1-piperazinyl)propoxy]phenyl]-4-(2-thiazolyl)-2-pyrimidinamine IUPAC Name: N-[3-[3-(4-ethylpiperazin-1-yl)propoxy]phenyl]-4-(1,3-thiazol-2-yl)pyrimidin-2-amine Traditional Name: [3-[3-(4-ethylpiperazino)propoxy]phenyl]-(4-thiazol-2-ylpyrimidin-2-yl)amine Formula: C22H28N6OS MolecularWeight: 424.56232

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCCOC2=CC=CC(=C2)NC3=NC=CC(=N3)C4=NC=CS4

Isomeric SMILES

CCN1CCN(CC1)CCCOC2=CC=CC(=C2)NC3=NC=CC(=N3)C4=NC=CS4

InChI

InChI=1S/C22H28N6OS/c1-2-27-11-13-28(14-12-27)10-4-15-29-19-6-3-5-18(17-19)25-22-24-8-7-20(26-22)21-23-9-16-30-21/h3,5-9,16-17H,2,4,10-15H2,1H3,(H,24,25,26)