2-[[2-(cyclohexylmethylsulfanyl)-1,3-benzothiazol-6-yl]sulfonyl-(phenylmethyl)amino]-N-oxidanyl-propanamide

Systemtic Name: 2-[[2-(cyclohexylmethylsulfanyl)-1,3-benzothiazol-6-yl]sulfonyl-(phenylmethyl)amino]-N-oxidanyl-propanamide Openeye Name: 2-[benzyl-[[2-(cyclohexylmethylsulfanyl)-1,3-benzothiazol-6-yl]sulfonyl]amino]propanehydroxamic acid CAS Name: 2-[[2-(cyclohexylmethylthio)-1,3-benzothiazol-6-yl]sulfonyl-(phenylmethyl)amino]-N-hydroxypropanamide IUPAC Name: 2-[benzyl-[[2-(cyclohexylmethylsulfanyl)-1,3-benzothiazol-6-yl]sulfonyl]amino]-N-hydroxypropanamide Traditional Name: 2-[benzyl-[[2-(cyclohexylmethylthio)-1,3-benzothiazol-6-yl]sulfonyl]amino]propanehydroxamic acid Formula: C24H29N3O4S3 MolecularWeight: 519.69976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NO)N(CC1=CC=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)SCC4CCCCC4

Isomeric SMILES

CC(C(=O)NO)N(CC1=CC=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)SCC4CCCCC4

InChI

InChI=1S/C24H29N3O4S3/c1-17(23(28)26-29)27(15-18-8-4-2-5-9-18)34(30,31)20-12-13-21-22(14-20)33-24(25-21)32-16-19-10-6-3-7-11-19/h2,4-5,8-9,12-14,17,19,29H,3,6-7,10-11,15-16H2,1H3,(H,26,28)