1-[(E)-[3-[(4-bromanylphenoxy)methyl]-4-methoxy-phenyl]methylideneamino]-3-phenyl-thiourea

Systemtic Name: 1-[(E)-[3-[(4-bromanylphenoxy)methyl]-4-methoxy-phenyl]methylideneamino]-3-phenyl-thiourea Openeye Name: 1-[(E)-[3-[(4-bromophenoxy)methyl]-4-methoxy-phenyl]methyleneamino]-3-phenyl-thiourea CAS Name: 1-[(E)-[3-[(4-bromophenoxy)methyl]-4-methoxyphenyl]methylideneamino]-3-phenylthiourea IUPAC Name: 1-[(E)-[3-[(4-bromophenoxy)methyl]-4-methoxyphenyl]methylideneamino]-3-phenylthiourea Traditional Name: 1-[(E)-[3-[(4-bromophenoxy)methyl]-4-methoxy-benzylidene]amino]-3-phenyl-thiourea Formula: C22H20BrN3O2S MolecularWeight: 470.3821

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=S)NC2=CC=CC=C2)COC3=CC=C(C=C3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=S)NC2=CC=CC=C2)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C22H20BrN3O2S/c1-27-21-12-7-16(13-17(21)15-28-20-10-8-18(23)9-11-20)14-24-26-22(29)25-19-5-3-2-4-6-19/h2-14H,15H2,1H3,(H2,25,26,29)/b24-14+