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(E)-3-(2-azanyl-4-pentadecylsulfanyl-phenyl)-1-phenyl-prop-2-en-1-one
(E)-3-(2-azanyl-4-pentadecylsulfanyl-phenyl)-1-phenyl-prop-2-en-1-one
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Descriptors Computed from Structure
Canonical SMILES:
CCCCCCCCCCCCCCCSC1=CC(=C(C=C1)C=CC(=O)C2=CC=CC=C2)N
Isomeric SMILES
CCCCCCCCCCCCCCCSC1=CC(=C(C=C1)/C=C/C(=O)C2=CC=CC=C2)N
InChI
InChI=1S/C30H43NOS/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-24-33-28-22-20-26(29(31)25-28)21-23-30(32)27-18-15-14-16-19-27/h14-16,18-23,25H,2-13,17,24,31H2,1H3/b23-21+
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- 3-(3-hydroxyphenyl)propanoic acid
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