3-[[4-ethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-2-yl]sulfanylmethyl]-N-morpholin-4-yl-benzamide

Systemtic Name: 3-[[4-ethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-2-yl]sulfanylmethyl]-N-morpholin-4-yl-benzamide Openeye Name: 3-[[4-ethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-2-yl]sulfanylmethyl]-N-morpholino-benzamide CAS Name: 3-[[[4-ethyl-6-(4-ethyl-1-piperazinyl)-2-pyrimidinyl]thio]methyl]-N-(4-morpholinyl)benzamide IUPAC Name: 3-[[4-ethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-2-yl]sulfanylmethyl]-N-morpholin-4-ylbenzamide Traditional Name: 3-[[[4-ethyl-6-(4-ethylpiperazino)pyrimidin-2-yl]thio]methyl]-N-morpholino-benzamide Formula: C24H34N6O2S MolecularWeight: 470.63076

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=N1)SCC2=CC=CC(=C2)C(=O)NN3CCOCC3)N4CCN(CC4)CC

Isomeric SMILES

CCC1=CC(=NC(=N1)SCC2=CC=CC(=C2)C(=O)NN3CCOCC3)N4CCN(CC4)CC

InChI

InChI=1S/C24H34N6O2S/c1-3-21-17-22(29-10-8-28(4-2)9-11-29)26-24(25-21)33-18-19-6-5-7-20(16-19)23(31)27-30-12-14-32-15-13-30/h5-7,16-17H,3-4,8-15,18H2,1-2H3,(H,27,31)