1-[(Z)-(7-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-3-(4-fluorophenyl)thiourea

Systemtic Name: 1-[(Z)-(7-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-3-(4-fluorophenyl)thiourea Openeye Name: 1-[(Z)-(7-bromo-1,3-benzodioxol-5-yl)methyleneamino]-3-(4-fluorophenyl)thiourea CAS Name: 1-[(Z)-(7-bromo-1,3-benzodioxol-5-yl)methylideneamino]-3-(4-fluorophenyl)thiourea IUPAC Name: 1-[(Z)-(7-bromo-1,3-benzodioxol-5-yl)methylideneamino]-3-(4-fluorophenyl)thiourea Traditional Name: 1-[(Z)-(7-bromo-1,3-benzodioxol-5-yl)methyleneamino]-3-(4-fluorophenyl)thiourea Formula: C15H11BrFN3O2S MolecularWeight: 396.234143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)C=NNC(=S)NC3=CC=C(C=C3)F)Br

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)/C=N\NC(=S)NC3=CC=C(C=C3)F)Br

InChI

InChI=1S/C15H11BrFN3O2S/c16-12-5-9(6-13-14(12)22-8-21-13)7-18-20-15(23)19-11-3-1-10(17)2-4-11/h1-7H,8H2,(H2,19,20,23)/b18-7-