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

Systemtic Name: 5-bromanyl-2-[(4-but-2-ynoxyphenyl)sulfonyl-methyl-amino]-3-(1-methylpiperidin-4-yl)-N-oxidanyl-benzamide Openeye Name: 5-bromo-2-[(4-but-2-ynoxyphenyl)sulfonyl-methyl-amino]-3-(1-methyl-4-piperidyl)benzenecarbohydroxamic acid CAS Name: 5-bromo-2-[(4-but-2-ynoxyphenyl)sulfonyl-methylamino]-N-hydroxy-3-(1-methyl-4-piperidinyl)benzamide IUPAC Name: 5-bromo-2-[(4-but-2-ynoxyphenyl)sulfonyl-methylamino]-N-hydroxy-3-(1-methylpiperidin-4-yl)benzamide Traditional Name: 5-bromo-2-[(4-but-2-ynoxyphenyl)sulfonyl-methyl-amino]-3-(1-methyl-4-piperidyl)benzenecarbohydroxamic acid Formula: C24H28BrN3O5S MolecularWeight: 550.46522

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N(C)C2=C(C=C(C=C2C(=O)NO)Br)C3CCN(CC3)C

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N(C)C2=C(C=C(C=C2C(=O)NO)Br)C3CCN(CC3)C

InChI

InChI=1S/C24H28BrN3O5S/c1-4-5-14-33-19-6-8-20(9-7-19)34(31,32)28(3)23-21(17-10-12-27(2)13-11-17)15-18(25)16-22(23)24(29)26-30/h6-9,15-17,30H,10-14H2,1-3H3,(H,26,29)