5-(1-benzothiophen-2-yl)-2-[[(4-methoxyphenyl)sulfonyl-pyridin-3-yl-methyl]amino]-3-methyl-N-oxidanyl-benzamide hydrochloride

Systemtic Name: 5-(1-benzothiophen-2-yl)-2-[[(4-methoxyphenyl)sulfonyl-pyridin-3-yl-methyl]amino]-3-methyl-N-oxidanyl-benzamide hydrochloride Openeye Name: 5-(benzothiophen-2-yl)-2-[[(4-methoxyphenyl)sulfonyl-(3-pyridyl)methyl]amino]-3-methyl-benzenecarbohydroxamic acid hydrochloride CAS Name: 5-(1-benzothiophen-2-yl)-N-hydroxy-2-[[(4-methoxyphenyl)sulfonyl-(3-pyridinyl)methyl]amino]-3-methylbenzamide hydrochloride IUPAC Name: 5-(1-benzothiophen-2-yl)-N-hydroxy-2-[[(4-methoxyphenyl)sulfonyl-pyridin-3-ylmethyl]amino]-3-methylbenzamide hydrochloride Traditional Name: 5-(benzothiophen-2-yl)-2-[[(4-methoxyphenyl)sulfonyl-(3-pyridyl)methyl]amino]-3-methyl-benzenecarbohydroxamic acid hydrochloride Formula: C29H26ClN3O5S2 MolecularWeight: 596.11684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(C2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OC)C(=O)NO)C4=CC5=CC=CC=C5S4.Cl

Isomeric SMILES

CC1=CC(=CC(=C1NC(C2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OC)C(=O)NO)C4=CC5=CC=CC=C5S4.Cl

InChI

InChI=1S/C29H25N3O5S2.ClH/c1-18-14-21(26-16-19-6-3-4-8-25(19)38-26)15-24(28(33)32-34)27(18)31-29(20-7-5-13-30-17-20)39(35,36)23-11-9-22(37-2)10-12-23;/h3-17,29,31,34H,1-2H3,(H,32,33);1H