N-[(11S)-11-[(4R)-4-ethyl-4,5-dihydro-1,3-oxazol-2-yl]-12-methyl-tridecyl]benzenesulfonamide

Systemtic Name: N-[(11S)-11-[(4R)-4-ethyl-4,5-dihydro-1,3-oxazol-2-yl]-12-methyl-tridecyl]benzenesulfonamide Openeye Name: N-[(11S)-11-[(4R)-4-ethyl-4,5-dihydrooxazol-2-yl]-12-methyl-tridecyl]benzenesulfonamide CAS Name: N-[(11S)-11-[(4R)-4-ethyl-4,5-dihydrooxazol-2-yl]-12-methyltridecyl]benzenesulfonamide IUPAC Name: N-[(11S)-11-[(4R)-4-ethyl-4,5-dihydro-1,3-oxazol-2-yl]-12-methyltridecyl]benzenesulfonamide Traditional Name: N-[(11S)-11-[(4R)-4-ethyl-2-oxazolin-2-yl]-12-methyl-tridecyl]benzenesulfonamide Formula: C25H42N2O3S MolecularWeight: 450.67758

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Descriptors Computed from Structure

Canonical SMILES:

CCC1COC(=N1)C(CCCCCCCCCCNS(=O)(=O)C2=CC=CC=C2)C(C)C

Isomeric SMILES

CC[C@@H]1COC(=N1)[C@@H](CCCCCCCCCCNS(=O)(=O)C2=CC=CC=C2)C(C)C

InChI

InChI=1S/C25H42N2O3S/c1-4-22-20-30-25(27-22)24(21(2)3)18-14-9-7-5-6-8-10-15-19-26-31(28,29)23-16-12-11-13-17-23/h11-13,16-17,21-22,24,26H,4-10,14-15,18-20H2,1-3H3/t22-,24+/m1/s1