5-[[4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methyl-pyrimidin-2-yl]sulfanylmethyl]-N-(pyridin-2-ylmethyl)furan-2-carboxamide

Systemtic Name: 5-[[4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methyl-pyrimidin-2-yl]sulfanylmethyl]-N-(pyridin-2-ylmethyl)furan-2-carboxamide Openeye Name: 5-[[4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methyl-pyrimidin-2-yl]sulfanylmethyl]-N-(2-pyridylmethyl)furan-2-carboxamide CAS Name: 5-[[[4-[4-(4-methoxyphenyl)-1-piperazinyl]-6-methyl-2-pyrimidinyl]thio]methyl]-N-(2-pyridinylmethyl)-2-furancarboxamide IUPAC Name: 5-[[4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl]sulfanylmethyl]-N-(pyridin-2-ylmethyl)furan-2-carboxamide Traditional Name: 5-[[[4-[4-(4-methoxyphenyl)piperazino]-6-methyl-pyrimidin-2-yl]thio]methyl]-N-(2-pyridylmethyl)-2-furamide Formula: C28H30N6O3S MolecularWeight: 530.6412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCC3=CC=CC=N3)N4CCN(CC4)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCC3=CC=CC=N3)N4CCN(CC4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C28H30N6O3S/c1-20-17-26(34-15-13-33(14-16-34)22-6-8-23(36-2)9-7-22)32-28(31-20)38-19-24-10-11-25(37-24)27(35)30-18-21-5-3-4-12-29-21/h3-12,17H,13-16,18-19H2,1-2H3,(H,30,35)