1-(1,3-benzodioxol-5-yl)-3-[2-(phenylmethyl)phenyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(phenylmethyl)phenyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(2-benzylphenyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(phenylmethyl)phenyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(2-benzylphenyl)thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(2-benzylphenyl)thiourea Formula: C21H18N2O2S MolecularWeight: 362.44482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=S)NC3=CC=CC=C3CC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=S)NC3=CC=CC=C3CC4=CC=CC=C4

InChI

InChI=1S/C21H18N2O2S/c26-21(22-17-10-11-19-20(13-17)25-14-24-19)23-18-9-5-4-8-16(18)12-15-6-2-1-3-7-15/h1-11,13H,12,14H2,(H2,22,23,26)