N-cyclohexyl-6-[1-(4-ethylpiperazin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-N-methyl-pyridine-3-sulfonamide

Systemtic Name: N-cyclohexyl-6-[1-(4-ethylpiperazin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-N-methyl-pyridine-3-sulfonamide Openeye Name: N-cyclohexyl-6-[2-(4-ethylpiperazin-1-yl)-1-methyl-2-oxo-ethyl]sulfanyl-N-methyl-pyridine-3-sulfonamide CAS Name: N-cyclohexyl-6-[[1-(4-ethyl-1-piperazinyl)-1-oxopropan-2-yl]thio]-N-methyl-3-pyridinesulfonamide IUPAC Name: N-cyclohexyl-6-[1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]sulfanyl-N-methylpyridine-3-sulfonamide Traditional Name: N-cyclohexyl-6-[[2-(4-ethylpiperazino)-2-keto-1-methyl-ethyl]thio]-N-methyl-pyridine-3-sulfonamide Formula: C21H34N4O3S2 MolecularWeight: 454.64966

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C(C)SC2=NC=C(C=C2)S(=O)(=O)N(C)C3CCCCC3

Isomeric SMILES

CCN1CCN(CC1)C(=O)C(C)SC2=NC=C(C=C2)S(=O)(=O)N(C)C3CCCCC3

InChI

InChI=1S/C21H34N4O3S2/c1-4-24-12-14-25(15-13-24)21(26)17(2)29-20-11-10-19(16-22-20)30(27,28)23(3)18-8-6-5-7-9-18/h10-11,16-18H,4-9,12-15H2,1-3H3