4-(4-but-2-ynoxyphenyl)sulfonyl-2,2-dimethyl-6-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-N-oxidanyl-thiomorpholine-3-carboxamide

Systemtic Name: 4-(4-but-2-ynoxyphenyl)sulfonyl-2,2-dimethyl-6-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-N-oxidanyl-thiomorpholine-3-carboxamide Openeye Name: 4-(4-but-2-ynoxyphenyl)sulfonyl-2,2-dimethyl-6-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]thiomorpholine-3-carbohydroxamic acid CAS Name: 4-(4-but-2-ynoxyphenyl)sulfonyl-N-hydroxy-2,2-dimethyl-6-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-3-thiomorpholinecarboxamide IUPAC Name: 4-(4-but-2-ynoxyphenyl)sulfonyl-N-hydroxy-2,2-dimethyl-6-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]thiomorpholine-3-carboxamide Traditional Name: 4-(4-but-2-ynoxyphenyl)sulfonyl-6-[2-keto-2-(4-methylpiperazino)ethyl]-2,2-dimethyl-thiomorpholine-3-carbohydroxamic acid Formula: C24H34N4O6S2 MolecularWeight: 538.67996

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N2CC(SC(C2C(=O)NO)(C)C)CC(=O)N3CCN(CC3)C

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N2CC(SC(C2C(=O)NO)(C)C)CC(=O)N3CCN(CC3)C

InChI

InChI=1S/C24H34N4O6S2/c1-5-6-15-34-18-7-9-20(10-8-18)36(32,33)28-17-19(35-24(2,3)22(28)23(30)25-31)16-21(29)27-13-11-26(4)12-14-27/h7-10,19,22,31H,11-17H2,1-4H3,(H,25,30)