1-[(E)-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)methylideneamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(E)-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)methylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(E)-(4-benzyloxy-3-bromo-5-methoxy-phenyl)methyleneamino]thiourea CAS Name: 1-[(E)-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(E)-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(E)-(4-benzoxy-3-bromo-5-methoxy-benzylidene)amino]thiourea Formula: C19H20BrN3O2S MolecularWeight: 434.35

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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