5-bromanyl-2-[(4-but-2-ynoxyphenyl)sulfonyl-[(4-methylpiperazin-1-yl)methyl]amino]-3-methyl-N-oxidanyl-benzamide

Systemtic Name: 5-bromanyl-2-[(4-but-2-ynoxyphenyl)sulfonyl-[(4-methylpiperazin-1-yl)methyl]amino]-3-methyl-N-oxidanyl-benzamide Openeye Name: 5-bromo-2-[(4-but-2-ynoxyphenyl)sulfonyl-[(4-methylpiperazin-1-yl)methyl]amino]-3-methyl-benzenecarbohydroxamic acid CAS Name: 5-bromo-2-[(4-but-2-ynoxyphenyl)sulfonyl-[(4-methyl-1-piperazinyl)methyl]amino]-N-hydroxy-3-methylbenzamide IUPAC Name: 5-bromo-2-[(4-but-2-ynoxyphenyl)sulfonyl-[(4-methylpiperazin-1-yl)methyl]amino]-N-hydroxy-3-methylbenzamide Traditional Name: 5-bromo-2-[(4-but-2-ynoxyphenyl)sulfonyl-[(4-methylpiperazino)methyl]amino]-3-methyl-benzenecarbohydroxamic acid Formula: C24H29BrN4O5S MolecularWeight: 565.47986

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N(CN2CCN(CC2)C)C3=C(C=C(C=C3C(=O)NO)Br)C

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N(CN2CCN(CC2)C)C3=C(C=C(C=C3C(=O)NO)Br)C

InChI

InChI=1S/C24H29BrN4O5S/c1-4-5-14-34-20-6-8-21(9-7-20)35(32,33)29(17-28-12-10-27(3)11-13-28)23-18(2)15-19(25)16-22(23)24(30)26-31/h6-9,15-16,31H,10-14,17H2,1-3H3,(H,26,30)