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

Systemtic Name: 1-[(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-methoxy-phenyl]methylideneamino]thiourea Openeye Name: [(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-methoxy-phenyl]methyleneamino]thiourea CAS Name: [(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-methoxyphenyl]methylideneamino]thiourea IUPAC Name: [(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-methoxyphenyl]methylideneamino]thiourea Traditional Name: [(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-methoxy-benzylidene]amino]thiourea Formula: C23H31N3O4S MolecularWeight: 445.57494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)C=NNC(=S)N)OC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)/C=N/NC(=S)N)OC

InChI

InChI=1S/C23H31N3O4S/c1-3-4-5-6-13-28-19-8-10-20(11-9-19)29-14-15-30-21-12-7-18(16-22(21)27-2)17-25-26-23(24)31/h7-12,16-17H,3-6,13-15H2,1-2H3,(H3,24,26,31)/b25-17+