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

Systemtic Name: 5-[[4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methyl-pyrimidin-2-yl]sulfanylmethyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide Openeye Name: 5-[[4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methyl-pyrimidin-2-yl]sulfanylmethyl]-N-[2-(2-pyridyl)ethyl]furan-2-carboxamide CAS Name: 5-[[[4-[4-(4-methoxyphenyl)-1-piperazinyl]-6-methyl-2-pyrimidinyl]thio]methyl]-N-[2-(2-pyridinyl)ethyl]-2-furancarboxamide IUPAC Name: 5-[[4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl]sulfanylmethyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide Traditional Name: 5-[[[4-[4-(4-methoxyphenyl)piperazino]-6-methyl-pyrimidin-2-yl]thio]methyl]-N-[2-(2-pyridyl)ethyl]-2-furamide Formula: C29H32N6O3S MolecularWeight: 544.66778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCCC3=CC=CC=N3)N4CCN(CC4)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCCC3=CC=CC=N3)N4CCN(CC4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C29H32N6O3S/c1-21-19-27(35-17-15-34(16-18-35)23-6-8-24(37-2)9-7-23)33-29(32-21)39-20-25-10-11-26(38-25)28(36)31-14-12-22-5-3-4-13-30-22/h3-11,13,19H,12,14-18,20H2,1-2H3,(H,31,36)