5-[[4-(4-ethylpiperazin-1-yl)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-(furan-2-ylmethyl)furan-2-carboxamide

Systemtic Name: 5-[[4-(4-ethylpiperazin-1-yl)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-(furan-2-ylmethyl)furan-2-carboxamide Openeye Name: 5-[[4-(4-ethylpiperazin-1-yl)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-(2-furylmethyl)furan-2-carboxamide CAS Name: 5-[[[4-(4-ethyl-1-piperazinyl)-6-phenyl-2-pyrimidinyl]thio]methyl]-N-(2-furanylmethyl)-2-furancarboxamide IUPAC Name: 5-[[4-(4-ethylpiperazin-1-yl)-6-phenylpyrimidin-2-yl]sulfanylmethyl]-N-(furan-2-ylmethyl)furan-2-carboxamide Traditional Name: 5-[[[4-(4-ethylpiperazino)-6-phenyl-pyrimidin-2-yl]thio]methyl]-N-(2-furfuryl)-2-furamide Formula: C27H29N5O3S MolecularWeight: 503.61586

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=NC(=C2)C3=CC=CC=C3)SCC4=CC=C(O4)C(=O)NCC5=CC=CO5

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=NC(=C2)C3=CC=CC=C3)SCC4=CC=C(O4)C(=O)NCC5=CC=CO5

InChI

InChI=1S/C27H29N5O3S/c1-2-31-12-14-32(15-13-31)25-17-23(20-7-4-3-5-8-20)29-27(30-25)36-19-22-10-11-24(35-22)26(33)28-18-21-9-6-16-34-21/h3-11,16-17H,2,12-15,18-19H2,1H3,(H,28,33)