(2S,3R,4S)-1-(4-methylphenyl)sulfonyl-N,2-bis(phenylmethyl)-4-prop-1-en-2-yl-piperidin-3-amine

Systemtic Name: (2S,3R,4S)-1-(4-methylphenyl)sulfonyl-N,2-bis(phenylmethyl)-4-prop-1-en-2-yl-piperidin-3-amine Openeye Name: (2S,3R,4S)-N,2-dibenzyl-4-isopropenyl-1-(p-tolylsulfonyl)piperidin-3-amine CAS Name: (2S,3R,4S)-4-(1-methylethenyl)-1-(4-methylphenyl)sulfonyl-N,2-bis(phenylmethyl)-3-piperidinamine IUPAC Name: (2S,3R,4S)-N,2-dibenzyl-1-(4-methylphenyl)sulfonyl-4-prop-1-en-2-ylpiperidin-3-amine Traditional Name: benzyl-[(2S,3R,4S)-2-benzyl-4-isopropenyl-1-tosyl-3-piperidyl]amine Formula: C29H34N2O2S MolecularWeight: 474.65746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(C(C2CC3=CC=CC=C3)NCC4=CC=CC=C4)C(=C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC[C@H]([C@H]([C@@H]2CC3=CC=CC=C3)NCC4=CC=CC=C4)C(=C)C

InChI

InChI=1S/C29H34N2O2S/c1-22(2)27-18-19-31(34(32,33)26-16-14-23(3)15-17-26)28(20-24-10-6-4-7-11-24)29(27)30-21-25-12-8-5-9-13-25/h4-17,27-30H,1,18-21H2,2-3H3/t27-,28-,29+/m0/s1