1-(1,3-benzodioxol-5-yl)-3-(2-methylsulfanylphenyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-(2-methylsulfanylphenyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(2-methylsulfanylphenyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(methylthio)phenyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(2-methylsulfanylphenyl)thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(methylthio)phenyl]thiourea Formula: C15H14N2O2S2 MolecularWeight: 318.41386

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=S)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CSC1=CC=CC=C1NC(=S)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H14N2O2S2/c1-21-14-5-3-2-4-11(14)17-15(20)16-10-6-7-12-13(8-10)19-9-18-12/h2-8H,9H2,1H3,(H2,16,17,20)