(2R)-2-[(4-chlorophenyl)-methylsulfonyl-amino]-N-(2-cyclohexylsulfanylethyl)propanamide

Systemtic Name: (2R)-2-[(4-chlorophenyl)-methylsulfonyl-amino]-N-(2-cyclohexylsulfanylethyl)propanamide Openeye Name: (2R)-2-(4-chloro-N-methylsulfonyl-anilino)-N-(2-cyclohexylsulfanylethyl)propanamide CAS Name: (2R)-2-(4-chloro-N-methylsulfonylanilino)-N-[2-(cyclohexylthio)ethyl]propanamide IUPAC Name: (2R)-2-(4-chloro-N-methylsulfonylanilino)-N-(2-cyclohexylsulfanylethyl)propanamide Traditional Name: (2R)-2-(4-chloro-N-mesyl-anilino)-N-[2-(cyclohexylthio)ethyl]propionamide Formula: C18H27ClN2O3S2 MolecularWeight: 419.00158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCSC1CCCCC1)N(C2=CC=C(C=C2)Cl)S(=O)(=O)C

Isomeric SMILES

C[C@H](C(=O)NCCSC1CCCCC1)N(C2=CC=C(C=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C18H27ClN2O3S2/c1-14(18(22)20-12-13-25-17-6-4-3-5-7-17)21(26(2,23)24)16-10-8-15(19)9-11-16/h8-11,14,17H,3-7,12-13H2,1-2H3,(H,20,22)/t14-/m1/s1