1-[(E)-[3-[(4-bromanylphenoxy)methyl]-4-methoxy-phenyl]methylideneamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(E)-[3-[(4-bromanylphenoxy)methyl]-4-methoxy-phenyl]methylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(E)-[3-[(4-bromophenoxy)methyl]-4-methoxy-phenyl]methyleneamino]thiourea CAS Name: 1-[(E)-[3-[(4-bromophenoxy)methyl]-4-methoxyphenyl]methylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(E)-[3-[(4-bromophenoxy)methyl]-4-methoxyphenyl]methylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(E)-[3-[(4-bromophenoxy)methyl]-4-methoxy-benzylidene]amino]thiourea Formula: C19H20BrN3O2S MolecularWeight: 434.35

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=S)NCC=C)COC2=CC=C(C=C2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=S)NCC=C)COC2=CC=C(C=C2)Br

InChI

InChI=1S/C19H20BrN3O2S/c1-3-10-21-19(26)23-22-12-14-4-9-18(24-2)15(11-14)13-25-17-7-5-16(20)6-8-17/h3-9,11-12H,1,10,13H2,2H3,(H2,21,23,26)/b22-12+