1-(1,3-benzodioxol-5-ylmethyl)-3-(4-phenylmethoxyphenyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-phenylmethoxyphenyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-benzyloxyphenyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-phenylmethoxyphenyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-phenylmethoxyphenyl)thiourea Traditional Name: 1-(4-benzoxyphenyl)-3-piperonyl-thiourea Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=S)NC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=S)NC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C22H20N2O3S/c28-22(23-13-17-6-11-20-21(12-17)27-15-26-20)24-18-7-9-19(10-8-18)25-14-16-4-2-1-3-5-16/h1-12H,13-15H2,(H2,23,24,28)