N-[2-(furan-2-ylmethylsulfanyl)ethyl]-5-(4-methylpiperazin-1-yl)sulfonyl-pyridin-2-amine

Systemtic Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-5-(4-methylpiperazin-1-yl)sulfonyl-pyridin-2-amine Openeye Name: N-[2-(2-furylmethylsulfanyl)ethyl]-5-(4-methylpiperazin-1-yl)sulfonyl-pyridin-2-amine CAS Name: N-[2-(2-furanylmethylthio)ethyl]-5-[(4-methyl-1-piperazinyl)sulfonyl]-2-pyridinamine IUPAC Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-amine Traditional Name: 2-(2-furfurylthio)ethyl-[5-(4-methylpiperazino)sulfonyl-2-pyridyl]amine Formula: C17H24N4O3S2 MolecularWeight: 396.52746

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)NCCSCC3=CC=CO3

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)NCCSCC3=CC=CO3

InChI

InChI=1S/C17H24N4O3S2/c1-20-7-9-21(10-8-20)26(22,23)16-4-5-17(19-13-16)18-6-12-25-14-15-3-2-11-24-15/h2-5,11,13H,6-10,12,14H2,1H3,(H,18,19)