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

Systemtic Name: N-(cyclopropylmethyl)-5-[[4-ethyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanylmethyl]furan-2-carboxamide Openeye Name: N-(cyclopropylmethyl)-5-[[4-ethyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanylmethyl]furan-2-carboxamide CAS Name: N-(cyclopropylmethyl)-5-[[[4-ethyl-6-[4-(4-methoxyphenyl)-1-piperazinyl]-2-pyrimidinyl]thio]methyl]-2-furancarboxamide IUPAC Name: N-(cyclopropylmethyl)-5-[[4-ethyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanylmethyl]furan-2-carboxamide Traditional Name: N-(cyclopropylmethyl)-5-[[[4-ethyl-6-[4-(4-methoxyphenyl)piperazino]pyrimidin-2-yl]thio]methyl]-2-furamide Formula: C27H33N5O3S MolecularWeight: 507.64762

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCC3CC3)N4CCN(CC4)C5=CC=C(C=C5)OC

Isomeric SMILES

CCC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCC3CC3)N4CCN(CC4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C27H33N5O3S/c1-3-20-16-25(32-14-12-31(13-15-32)21-6-8-22(34-2)9-7-21)30-27(29-20)36-18-23-10-11-24(35-23)26(33)28-17-19-4-5-19/h6-11,16,19H,3-5,12-15,17-18H2,1-2H3,(H,28,33)