(2S,3S)-2,3-bis(cyclohexylsulfanyl)-4-phenyl-N-(phenylmethyl)butan-1-amine

Systemtic Name: (2S,3S)-2,3-bis(cyclohexylsulfanyl)-4-phenyl-N-(phenylmethyl)butan-1-amine Openeye Name: (2S,3S)-N-benzyl-2,3-bis(cyclohexylsulfanyl)-4-phenyl-butan-1-amine CAS Name: (2S,3S)-2,3-bis(cyclohexylthio)-4-phenyl-N-(phenylmethyl)-1-butanamine IUPAC Name: (2S,3S)-N-benzyl-2,3-bis(cyclohexylsulfanyl)-4-phenylbutan-1-amine Traditional Name: benzyl-[(2S,3S)-2,3-bis(cyclohexylthio)-4-phenyl-butyl]amine Formula: C29H41NS2 MolecularWeight: 467.77254

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SC(CC2=CC=CC=C2)C(CNCC3=CC=CC=C3)SC4CCCCC4

Isomeric SMILES

C1CCC(CC1)S[C@@H](CC2=CC=CC=C2)[C@H](CNCC3=CC=CC=C3)SC4CCCCC4

InChI

InChI=1S/C29H41NS2/c1-5-13-24(14-6-1)21-28(31-26-17-9-3-10-18-26)29(32-27-19-11-4-12-20-27)23-30-22-25-15-7-2-8-16-25/h1-2,5-8,13-16,26-30H,3-4,9-12,17-23H2/t28-,29-/m0/s1