N-ethyl-5-[[4-ethyl-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanylmethyl]-N-methyl-furan-2-carboxamide

Systemtic Name: N-ethyl-5-[[4-ethyl-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanylmethyl]-N-methyl-furan-2-carboxamide Openeye Name: N-ethyl-5-[[4-ethyl-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanylmethyl]-N-methyl-furan-2-carboxamide CAS Name: N-ethyl-5-[[[4-ethyl-6-[4-(2-fluorophenyl)-1-piperazinyl]-2-pyrimidinyl]thio]methyl]-N-methyl-2-furancarboxamide IUPAC Name: N-ethyl-5-[[4-ethyl-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanylmethyl]-N-methylfuran-2-carboxamide Traditional Name: N-ethyl-5-[[[4-ethyl-6-[4-(2-fluorophenyl)piperazino]pyrimidin-2-yl]thio]methyl]-N-methyl-2-furamide Formula: C25H30FN5O2S MolecularWeight: 483.601403

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)N(C)CC)N3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

CCC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)N(C)CC)N3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C25H30FN5O2S/c1-4-18-16-23(31-14-12-30(13-15-31)21-9-7-6-8-20(21)26)28-25(27-18)34-17-19-10-11-22(33-19)24(32)29(3)5-2/h6-11,16H,4-5,12-15,17H2,1-3H3