1-(1,3-benzodioxol-5-ylmethyl)-3-[(5-chloranyl-2-oxidanyl-phenyl)carbonylamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(5-chloranyl-2-oxidanyl-phenyl)carbonylamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(5-chloro-2-hydroxy-benzoyl)amino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[(5-chloro-2-hydroxyphenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(5-chloro-2-hydroxybenzoyl)amino]thiourea Traditional Name: 1-[(5-chloro-2-hydroxy-benzoyl)amino]-3-piperonyl-thiourea Formula: C16H14ClN3O4S MolecularWeight: 379.81806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14ClN3O4S/c17-10-2-3-12(21)11(6-10)15(22)19-20-16(25)18-7-9-1-4-13-14(5-9)24-8-23-13/h1-6,21H,7-8H2,(H,19,22)(H2,18,20,25)