1-(1,3-benzodioxol-5-ylmethyl)-3-[3-(hydroxymethyl)phenyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[3-(hydroxymethyl)phenyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[3-(hydroxymethyl)phenyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[3-(hydroxymethyl)phenyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[3-(hydroxymethyl)phenyl]thiourea Traditional Name: 1-(3-methylolphenyl)-3-piperonyl-thiourea Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O3S/c19-9-12-2-1-3-13(6-12)18-16(22)17-8-11-4-5-14-15(7-11)21-10-20-14/h1-7,19H,8-10H2,(H2,17,18,22)