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1,3-bis(3-methyl-6-oxidanyl-3-phenyl-hexyl)thiourea

1,3-bis(3-methyl-6-oxidanyl-3-phenyl-hexyl)thiourea

Systemtic Name:1,3-bis(3-methyl-6-oxidanyl-3-phenyl-hexyl)thiourea
Openeye Name:1,3-bis(6-hydroxy-3-methyl-3-phenyl-hexyl)thiourea
CAS Name:1,3-bis(6-hydroxy-3-methyl-3-phenylhexyl)thiourea
IUPAC Name:1,3-bis(6-hydroxy-3-methyl-3-phenylhexyl)thiourea
Traditional Name:1,3-bis(6-hydroxy-3-methyl-3-phenyl-hexyl)thiourea
Formula: C27H40N2O2S
MolecularWeight: 456.6837
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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCO)(CCNC(=S)NCCC(C)(CCCO)C1=CC=CC=C1)C2=CC=CC=C2


Isomeric SMILES

CC(CCCO)(CCNC(=S)NCCC(C)(CCCO)C1=CC=CC=C1)C2=CC=CC=C2


InChI

InChI=1S/C27H40N2O2S/c1-26(15-9-21-30,23-11-5-3-6-12-23)17-19-28-25(32)29-20-18-27(2,16-10-22-31)24-13-7-4-8-14-24/h3-8,11-14,30-31H,9-10,15-22H2,1-2H3,(H2,28,29,32)


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