N-(cyclohexen-1-yl)-N-(furan-2-ylmethyl)-2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(cyclohexen-1-yl)-N-(furan-2-ylmethyl)-2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(cyclohexen-1-yl)-N-(2-furylmethyl)-2-[[5-(4-methylpiperazin-1-yl)sulfonyl-2-pyridyl]sulfanyl]acetamide CAS Name: N-(1-cyclohexenyl)-N-(2-furanylmethyl)-2-[[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-pyridinyl]thio]acetamide IUPAC Name: N-(cyclohexen-1-yl)-N-(furan-2-ylmethyl)-2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanylacetamide Traditional Name: N-(cyclohexen-1-yl)-N-(2-furfuryl)-2-[[5-(4-methylpiperazino)sulfonyl-2-pyridyl]thio]acetamide Formula: C23H30N4O4S2 MolecularWeight: 490.6387

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)N(CC3=CC=CO3)C4=CCCCC4

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)N(CC3=CC=CO3)C4=CCCCC4

InChI

InChI=1S/C23H30N4O4S2/c1-25-11-13-26(14-12-25)33(29,30)21-9-10-22(24-16-21)32-18-23(28)27(17-20-8-5-15-31-20)19-6-3-2-4-7-19/h5-6,8-10,15-16H,2-4,7,11-14,17-18H2,1H3