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5-(octadecylamino)-2-phenylsulfanyl-phenol

5-(octadecylamino)-2-phenylsulfanyl-phenol

Systemtic Name:5-(octadecylamino)-2-phenylsulfanyl-phenol
Openeye Name:5-(octadecylamino)-2-phenylsulfanyl-phenol
CAS Name:5-(octadecylamino)-2-(phenylthio)phenol
IUPAC Name:5-(octadecylamino)-2-phenylsulfanylphenol
Traditional Name:2-(phenylthio)-5-(stearylamino)phenol
Formula: C30H47NOS
MolecularWeight: 469.76528
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC1=CC(=C(C=C1)SC2=CC=CC=C2)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC1=CC(=C(C=C1)SC2=CC=CC=C2)O


InChI

InChI=1S/C30H47NOS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-25-31-27-23-24-30(29(32)26-27)33-28-21-18-17-19-22-28/h17-19,21-24,26,31-32H,2-16,20,25H2,1H3


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