N-methyl-N-[11-[(4S,5R)-4-methyl-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]dodecyl]benzenesulfonamide

Systemtic Name: N-methyl-N-[11-[(4S,5R)-4-methyl-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]dodecyl]benzenesulfonamide Openeye Name: N-methyl-N-[11-[(4S,5R)-4-methyl-5-phenyl-4,5-dihydrooxazol-2-yl]dodecyl]benzenesulfonamide CAS Name: N-methyl-N-[11-[(4S,5R)-4-methyl-5-phenyl-4,5-dihydrooxazol-2-yl]dodecyl]benzenesulfonamide IUPAC Name: N-methyl-N-[11-[(4S,5R)-4-methyl-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]dodecyl]benzenesulfonamide Traditional Name: N-methyl-N-[11-[(4S,5R)-4-methyl-5-phenyl-2-oxazolin-2-yl]dodecyl]benzenesulfonamide Formula: C29H42N2O3S MolecularWeight: 498.72038

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC(=N1)C(C)CCCCCCCCCCN(C)S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C[C@H]1[C@H](OC(=N1)C(C)CCCCCCCCCCN(C)S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C29H42N2O3S/c1-24(29-30-25(2)28(34-29)26-19-13-10-14-20-26)18-12-8-6-4-5-7-9-17-23-31(3)35(32,33)27-21-15-11-16-22-27/h10-11,13-16,19-22,24-25,28H,4-9,12,17-18,23H2,1-3H3/t24?,25-,28-/m0/s1