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

Systemtic Name: 5-[[4-(4-ethanoylpiperazin-1-yl)-6-ethyl-pyrimidin-2-yl]sulfanylmethyl]-N-ethyl-N-methyl-furan-2-carboxamide Openeye Name: 5-[[4-(4-acetylpiperazin-1-yl)-6-ethyl-pyrimidin-2-yl]sulfanylmethyl]-N-ethyl-N-methyl-furan-2-carboxamide CAS Name: 5-[[[4-(4-acetyl-1-piperazinyl)-6-ethyl-2-pyrimidinyl]thio]methyl]-N-ethyl-N-methyl-2-furancarboxamide IUPAC Name: 5-[[4-(4-acetylpiperazin-1-yl)-6-ethylpyrimidin-2-yl]sulfanylmethyl]-N-ethyl-N-methylfuran-2-carboxamide Traditional Name: 5-[[[4-(4-acetylpiperazino)-6-ethyl-pyrimidin-2-yl]thio]methyl]-N-ethyl-N-methyl-2-furamide Formula: C21H29N5O3S MolecularWeight: 431.55166

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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)C(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C21H29N5O3S/c1-5-16-13-19(26-11-9-25(10-12-26)15(3)27)23-21(22-16)30-14-17-7-8-18(29-17)20(28)24(4)6-2/h7-8,13H,5-6,9-12,14H2,1-4H3