[(4E)-4-diazanylidene-2,6-diphenyl-thian-2-yl] 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoate

Systemtic Name: [(4E)-4-diazanylidene-2,6-diphenyl-thian-2-yl] 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoate Openeye Name: [(4E)-4-hydrazinylidene-2,6-diphenyl-tetrahydrothiopyran-2-yl] 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoate CAS Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoic acid [(4E)-4-hydrazinylidene-2,6-diphenyl-2-thianyl] ester IUPAC Name: [(4E)-4-hydrazinylidene-2,6-diphenylthian-2-yl] 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate Traditional Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propionic acid [(4E)-4-hydrazono-2,6-diphenyl-tetrahydrothiopyran-2-yl] ester Formula: C34H42N2O3S MolecularWeight: 558.77388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)OC2(CC(=NN)CC(S2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)OC2(C/C(=N/N)/CC(S2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C34H42N2O3S/c1-32(2,3)27-19-23(20-28(31(27)38)33(4,5)6)17-18-30(37)39-34(25-15-11-8-12-16-25)22-26(36-35)21-29(40-34)24-13-9-7-10-14-24/h7-16,19-20,29,38H,17-18,21-22,35H2,1-6H3/b36-26+