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

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

Systemtic Name:1-butyl-3-[(3-methoxy-4-oxidanyl-phenyl)methyl]thiourea
Openeye Name:1-butyl-3-[(4-hydroxy-3-methoxy-phenyl)methyl]thiourea
CAS Name:1-butyl-3-[(4-hydroxy-3-methoxyphenyl)methyl]thiourea
IUPAC Name:1-butyl-3-[(4-hydroxy-3-methoxyphenyl)methyl]thiourea
Traditional Name:1-butyl-3-vanillyl-thiourea
Formula: C13H20N2O2S
MolecularWeight: 268.3751
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C13H20N2O2S/c1-3-4-7-14-13(18)15-9-10-5-6-11(16)12(8-10)17-2/h5-6,8,16H,3-4,7,9H2,1-2H3,(H2,14,15,18)


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