(2S,4R)-4-methyl-1,4-bis-(4-methylphenyl)sulfonyl-2-(phenylmethyl)-2,3-dihydropyridine

Systemtic Name: (2S,4R)-4-methyl-1,4-bis-(4-methylphenyl)sulfonyl-2-(phenylmethyl)-2,3-dihydropyridine Openeye Name: (2S,4R)-2-benzyl-4-methyl-1,4-bis(p-tolylsulfonyl)-2,3-dihydropyridine CAS Name: (2S,4R)-4-methyl-1,4-bis-(4-methylphenyl)sulfonyl-2-(phenylmethyl)-2,3-dihydropyridine IUPAC Name: (2S,4R)-2-benzyl-4-methyl-1,4-bis-(4-methylphenyl)sulfonyl-2,3-dihydropyridine Traditional Name: (2S,4R)-2-benzyl-4-methyl-1,4-ditosyl-2,3-dihydropyridine Formula: C27H29NO4S2 MolecularWeight: 495.65346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2(CC(N(C=C2)S(=O)(=O)C3=CC=C(C=C3)C)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[C@@]2(C[C@@H](N(C=C2)S(=O)(=O)C3=CC=C(C=C3)C)CC4=CC=CC=C4)C

InChI

InChI=1S/C27H29NO4S2/c1-21-9-13-25(14-10-21)33(29,30)27(3)17-18-28(24(20-27)19-23-7-5-4-6-8-23)34(31,32)26-15-11-22(2)12-16-26/h4-18,24H,19-20H2,1-3H3/t24-,27-/m0/s1