1-[(E)-(5-bromanyl-2-phenylmethoxy-phenyl)methylideneamino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[(E)-(5-bromanyl-2-phenylmethoxy-phenyl)methylideneamino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[(E)-(2-benzyloxy-5-bromo-phenyl)methyleneamino]thiourea CAS Name: 1-[(E)-(5-bromo-2-phenylmethoxyphenyl)methylideneamino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[(E)-(5-bromo-2-phenylmethoxyphenyl)methylideneamino]thiourea Traditional Name: 1-[(E)-(2-benzoxy-5-bromo-benzylidene)amino]-3-benzyl-thiourea Formula: C22H20BrN3OS MolecularWeight: 454.3827

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NN=CC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)N/N=C/C2=C(C=CC(=C2)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C22H20BrN3OS/c23-20-11-12-21(27-16-18-9-5-2-6-10-18)19(13-20)15-25-26-22(28)24-14-17-7-3-1-4-8-17/h1-13,15H,14,16H2,(H2,24,26,28)/b25-15+