3-(4-azanyl-3-tert-butyl-5-methyl-phenyl)sulfanyl-1-octadecyl-pyrrolidine-2,5-dione

Systemtic Name: 3-(4-azanyl-3-tert-butyl-5-methyl-phenyl)sulfanyl-1-octadecyl-pyrrolidine-2,5-dione Openeye Name: 3-(4-amino-3-tert-butyl-5-methyl-phenyl)sulfanyl-1-octadecyl-pyrrolidine-2,5-dione CAS Name: 3-[(4-amino-3-tert-butyl-5-methylphenyl)thio]-1-octadecylpyrrolidine-2,5-dione IUPAC Name: 3-(4-amino-3-tert-butyl-5-methylphenyl)sulfanyl-1-octadecylpyrrolidine-2,5-dione Traditional Name: 3-[(4-amino-3-tert-butyl-5-methyl-phenyl)thio]-1-stearyl-pyrrolidine-2,5-quinone Formula: C33H56N2O2S MolecularWeight: 544.87494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN1C(=O)CC(C1=O)SC2=CC(=C(C(=C2)C)N)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN1C(=O)CC(C1=O)SC2=CC(=C(C(=C2)C)N)C(C)(C)C

InChI

InChI=1S/C33H56N2O2S/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-35-30(36)25-29(32(35)37)38-27-23-26(2)31(34)28(24-27)33(3,4)5/h23-24,29H,6-22,25,34H2,1-5H3