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1-[(E)-[3-[2-(4-hexylphenoxy)ethoxy]phenyl]methylideneamino]thiourea

1-[(E)-[3-[2-(4-hexylphenoxy)ethoxy]phenyl]methylideneamino]thiourea

Systemtic Name:1-[(E)-[3-[2-(4-hexylphenoxy)ethoxy]phenyl]methylideneamino]thiourea
Openeye Name:[(E)-[3-[2-(4-hexylphenoxy)ethoxy]phenyl]methyleneamino]thiourea
CAS Name:[(E)-[3-[2-(4-hexylphenoxy)ethoxy]phenyl]methylideneamino]thiourea
IUPAC Name:[(E)-[3-[2-(4-hexylphenoxy)ethoxy]phenyl]methylideneamino]thiourea
Traditional Name:[(E)-[3-[2-(4-hexylphenoxy)ethoxy]benzylidene]amino]thiourea
Formula: C22H29N3O2S
MolecularWeight: 399.54956
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)OCCOC2=CC=CC(=C2)C=NNC(=S)N


Isomeric SMILES

CCCCCCC1=CC=C(C=C1)OCCOC2=CC=CC(=C2)/C=N/NC(=S)N


InChI

InChI=1S/C22H29N3O2S/c1-2-3-4-5-7-18-10-12-20(13-11-18)26-14-15-27-21-9-6-8-19(16-21)17-24-25-22(23)28/h6,8-13,16-17H,2-5,7,14-15H2,1H3,(H3,23,25,28)/b24-17+


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