1-[(E)-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)methylideneamino]thiourea

Systemtic Name: 1-[(E)-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)methylideneamino]thiourea Openeye Name: [(E)-(4-benzyloxy-3-bromo-5-methoxy-phenyl)methyleneamino]thiourea CAS Name: [(E)-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methylideneamino]thiourea IUPAC Name: [(E)-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methylideneamino]thiourea Traditional Name: [(E)-(4-benzoxy-3-bromo-5-methoxy-benzylidene)amino]thiourea Formula: C16H16BrN3O2S MolecularWeight: 394.28614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=S)N)Br)OCC2=CC=CC=C2

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N/NC(=S)N)Br)OCC2=CC=CC=C2

InChI

InChI=1S/C16H16BrN3O2S/c1-21-14-8-12(9-19-20-16(18)23)7-13(17)15(14)22-10-11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H3,18,20,23)/b19-9+