methyl (3S,4R)-4-[(S)-(1-methylimidazol-2-yl)sulfinyl]-3,5-diphenyl-pentanoate

Systemtic Name: methyl (3S,4R)-4-[(S)-(1-methylimidazol-2-yl)sulfinyl]-3,5-diphenyl-pentanoate Openeye Name: methyl (3S,4R)-4-[(S)-(1-methylimidazol-2-yl)sulfinyl]-3,5-diphenyl-pentanoate CAS Name: (3S,4R)-4-[(S)-(1-methyl-2-imidazolyl)sulfinyl]-3,5-diphenylpentanoic acid methyl ester IUPAC Name: methyl (3S,4R)-4-[(S)-(1-methylimidazol-2-yl)sulfinyl]-3,5-diphenylpentanoate Traditional Name: (3S,4R)-4-[(S)-(1-methylimidazol-2-yl)sulfinyl]-3,5-diphenyl-valeric acid methyl ester Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1S(=O)C(CC2=CC=CC=C2)C(CC(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CN1C=CN=C1[S@@](=O)[C@H](CC2=CC=CC=C2)[C@@H](CC(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C22H24N2O3S/c1-24-14-13-23-22(24)28(26)20(15-17-9-5-3-6-10-17)19(16-21(25)27-2)18-11-7-4-8-12-18/h3-14,19-20H,15-16H2,1-2H3/t19-,20+,28-/m0/s1