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1-[(3-methoxy-4-oxidanyl-phenyl)methyl]-3-octadecyl-thiourea

1-[(3-methoxy-4-oxidanyl-phenyl)methyl]-3-octadecyl-thiourea

Systemtic Name:1-[(3-methoxy-4-oxidanyl-phenyl)methyl]-3-octadecyl-thiourea
Openeye Name:1-[(4-hydroxy-3-methoxy-phenyl)methyl]-3-octadecyl-thiourea
CAS Name:1-[(4-hydroxy-3-methoxyphenyl)methyl]-3-octadecylthiourea
IUPAC Name:1-[(4-hydroxy-3-methoxyphenyl)methyl]-3-octadecylthiourea
Traditional Name:1-stearyl-3-vanillyl-thiourea
Formula: C27H48N2O2S
MolecularWeight: 464.74722
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=S)NCC1=CC(=C(C=C1)O)OC


Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=S)NCC1=CC(=C(C=C1)O)OC


InChI

InChI=1S/C27H48N2O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-28-27(32)29-23-24-19-20-25(30)26(22-24)31-2/h19-20,22,30H,3-18,21,23H2,1-2H3,(H2,28,29,32)


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