2-methyl-N-[4-[2-[[1-(4-methylsulfanylbutyl)cyclopentyl]carbonylamino]-3-oxidanyl-propyl]phenyl]-6-nitro-benzamide

Systemtic Name: 2-methyl-N-[4-[2-[[1-(4-methylsulfanylbutyl)cyclopentyl]carbonylamino]-3-oxidanyl-propyl]phenyl]-6-nitro-benzamide Openeye Name: N-[4-[3-hydroxy-2-[[1-(4-methylsulfanylbutyl)cyclopentanecarbonyl]amino]propyl]phenyl]-2-methyl-6-nitro-benzamide CAS Name: N-[4-[3-hydroxy-2-[[[1-[4-(methylthio)butyl]cyclopentyl]-oxomethyl]amino]propyl]phenyl]-2-methyl-6-nitrobenzamide IUPAC Name: N-[4-[3-hydroxy-2-[[1-(4-methylsulfanylbutyl)cyclopentanecarbonyl]amino]propyl]phenyl]-2-methyl-6-nitrobenzamide Traditional Name: N-[4-[3-hydroxy-2-[[1-[4-(methylthio)butyl]cyclopentanecarbonyl]amino]propyl]phenyl]-2-methyl-6-nitro-benzamide Formula: C28H37N3O5S MolecularWeight: 527.67548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)CC(CO)NC(=O)C3(CCCC3)CCCCSC

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)CC(CO)NC(=O)C3(CCCC3)CCCCSC

InChI

InChI=1S/C28H37N3O5S/c1-20-8-7-9-24(31(35)36)25(20)26(33)29-22-12-10-21(11-13-22)18-23(19-32)30-27(34)28(14-3-4-15-28)16-5-6-17-37-2/h7-13,23,32H,3-6,14-19H2,1-2H3,(H,29,33)(H,30,34)