(2S)-2-(cyclohexylmethyl)-2-[(3-oxidanyl-5,5,5-triphenyl-pentanethioyl)amino]-N-phenethyl-nonanamide

Systemtic Name: (2S)-2-(cyclohexylmethyl)-2-[(3-oxidanyl-5,5,5-triphenyl-pentanethioyl)amino]-N-phenethyl-nonanamide Openeye Name: (2S)-2-(cyclohexylmethyl)-2-[(3-hydroxy-5,5,5-triphenyl-pentanethioyl)amino]-N-phenethyl-nonanamide CAS Name: (2S)-2-(cyclohexylmethyl)-2-[(3-hydroxy-5,5,5-triphenyl-1-sulfanylidenepentyl)amino]-N-phenethylnonanamide IUPAC Name: (2S)-2-(cyclohexylmethyl)-2-[(3-hydroxy-5,5,5-triphenylpentanethioyl)amino]-N-phenethylnonanamide Traditional Name: (2S)-2-(cyclohexylmethyl)-2-[(3-hydroxy-5,5,5-triphenyl-pentanethioyl)amino]-N-phenethyl-pelargonamide Formula: C47H60N2O2S MolecularWeight: 717.0565

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CC1CCCCC1)(C(=O)NCCC2=CC=CC=C2)NC(=S)CC(CC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)O

Isomeric SMILES

CCCCCCC[C@](CC1CCCCC1)(C(=O)NCCC2=CC=CC=C2)NC(=S)CC(CC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)O

InChI

InChI=1S/C47H60N2O2S/c1-2-3-4-5-21-33-46(36-39-24-13-7-14-25-39,45(51)48-34-32-38-22-11-6-12-23-38)49-44(52)35-43(50)37-47(40-26-15-8-16-27-40,41-28-17-9-18-29-41)42-30-19-10-20-31-42/h6,8-12,15-20,22-23,26-31,39,43,50H,2-5,7,13-14,21,24-25,32-37H2,1H3,(H,48,51)(H,49,52)/t43?,46-/m0/s1