1-(1,3-benzodioxol-5-yl)-3-[(2-bromophenyl)methyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[(2-bromophenyl)methyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[(2-bromophenyl)methyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[(2-bromophenyl)methyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[(2-bromophenyl)methyl]thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(2-bromobenzyl)thiourea Formula: C15H13BrN2O2S MolecularWeight: 365.24492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=S)NCC3=CC=CC=C3Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=S)NCC3=CC=CC=C3Br

InChI

InChI=1S/C15H13BrN2O2S/c16-12-4-2-1-3-10(12)8-17-15(21)18-11-5-6-13-14(7-11)20-9-19-13/h1-7H,8-9H2,(H2,17,18,21)