N-[5-chloranyl-4-[3-(4-methylphenyl)sulfonylbutanoylamino]-2-oxidanyl-phenyl]-1-(cyclohexylmethyl)cyclohexane-1-carboxamide

Systemtic Name: N-[5-chloranyl-4-[3-(4-methylphenyl)sulfonylbutanoylamino]-2-oxidanyl-phenyl]-1-(cyclohexylmethyl)cyclohexane-1-carboxamide Openeye Name: N-[5-chloro-2-hydroxy-4-[3-(p-tolylsulfonyl)butanoylamino]phenyl]-1-(cyclohexylmethyl)cyclohexanecarboxamide CAS Name: N-[5-chloro-2-hydroxy-4-[[3-(4-methylphenyl)sulfonyl-1-oxobutyl]amino]phenyl]-1-(cyclohexylmethyl)-1-cyclohexanecarboxamide IUPAC Name: N-[5-chloro-2-hydroxy-4-[3-(4-methylphenyl)sulfonylbutanoylamino]phenyl]-1-(cyclohexylmethyl)cyclohexane-1-carboxamide Traditional Name: N-[5-chloro-2-hydroxy-4-(3-tosylbutanoylamino)phenyl]-1-(cyclohexylmethyl)cyclohexanecarboxamide Formula: C31H41ClN2O5S MolecularWeight: 589.18564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C)CC(=O)NC2=CC(=C(C=C2Cl)NC(=O)C3(CCCCC3)CC4CCCCC4)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(C)CC(=O)NC2=CC(=C(C=C2Cl)NC(=O)C3(CCCCC3)CC4CCCCC4)O

InChI

InChI=1S/C31H41ClN2O5S/c1-21-11-13-24(14-12-21)40(38,39)22(2)17-29(36)33-26-19-28(35)27(18-25(26)32)34-30(37)31(15-7-4-8-16-31)20-23-9-5-3-6-10-23/h11-14,18-19,22-23,35H,3-10,15-17,20H2,1-2H3,(H,33,36)(H,34,37)