1-(1,3-benzodioxol-5-ylmethyl)-3-[(3-hydroxyphenyl)carbonylamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(3-hydroxyphenyl)carbonylamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(3-hydroxybenzoyl)amino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[(3-hydroxyphenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(3-hydroxybenzoyl)amino]thiourea Traditional Name: 1-[(3-hydroxybenzoyl)amino]-3-piperonyl-thiourea Formula: C16H15N3O4S MolecularWeight: 345.373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O4S/c20-12-3-1-2-11(7-12)15(21)18-19-16(24)17-8-10-4-5-13-14(6-10)23-9-22-13/h1-7,20H,8-9H2,(H,18,21)(H2,17,19,24)