(2R)-2-[(4-methoxyphenyl)sulfonylamino]-N-(7-methyloctyl)-4-methylsulfanyl-butanamide

Systemtic Name: (2R)-2-[(4-methoxyphenyl)sulfonylamino]-N-(7-methyloctyl)-4-methylsulfanyl-butanamide Openeye Name: (2R)-2-[(4-methoxyphenyl)sulfonylamino]-N-(7-methyloctyl)-4-methylsulfanyl-butanamide CAS Name: (2R)-2-[(4-methoxyphenyl)sulfonylamino]-N-(7-methyloctyl)-4-(methylthio)butanamide IUPAC Name: (2R)-2-[(4-methoxyphenyl)sulfonylamino]-N-(7-methyloctyl)-4-methylsulfanylbutanamide Traditional Name: (2R)-2-[(4-methoxyphenyl)sulfonylamino]-N-(7-methyloctyl)-4-(methylthio)butyramide Formula: C21H36N2O4S2 MolecularWeight: 444.65154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCNC(=O)C(CCSC)NS(=O)(=O)C1=CC=C(C=C1)OC

Isomeric SMILES

CC(C)CCCCCCNC(=O)[C@@H](CCSC)NS(=O)(=O)C1=CC=C(C=C1)OC

InChI

InChI=1S/C21H36N2O4S2/c1-17(2)9-7-5-6-8-15-22-21(24)20(14-16-28-4)23-29(25,26)19-12-10-18(27-3)11-13-19/h10-13,17,20,23H,5-9,14-16H2,1-4H3,(H,22,24)/t20-/m1/s1