1-(1,3-benzodioxol-5-ylcarbonylamino)-3-(4-chlorophenyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylcarbonylamino)-3-(4-chlorophenyl)thiourea Openeye Name: 1-(1,3-benzodioxole-5-carbonylamino)-3-(4-chlorophenyl)thiourea CAS Name: 1-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-3-(4-chlorophenyl)thiourea IUPAC Name: 1-(1,3-benzodioxole-5-carbonylamino)-3-(4-chlorophenyl)thiourea Traditional Name: 1-(4-chlorophenyl)-3-(piperonyloylamino)thiourea Formula: C15H12ClN3O3S MolecularWeight: 349.79208

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NNC(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NNC(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H12ClN3O3S/c16-10-2-4-11(5-3-10)17-15(23)19-18-14(20)9-1-6-12-13(7-9)22-8-21-12/h1-7H,8H2,(H,18,20)(H2,17,19,23)