1-(1,3-benzodioxol-5-ylmethyl)-3-[(4-chlorophenyl)amino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(4-chlorophenyl)amino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-chloroanilino)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-chloroanilino)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-chloroanilino)thiourea Traditional Name: 1-(4-chloroanilino)-3-piperonyl-thiourea Formula: C15H14ClN3O2S MolecularWeight: 335.80856

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=S)NNC3=CC=C(C=C3)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=S)NNC3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H14ClN3O2S/c16-11-2-4-12(5-3-11)18-19-15(22)17-8-10-1-6-13-14(7-10)21-9-20-13/h1-7,18H,8-9H2,(H2,17,19,22)