1-(1,3-benzodioxol-5-ylmethyl)-3-(1-phenylethyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(1-phenylethyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(1-phenylethyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(1-phenylethyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(1-phenylethyl)thiourea Traditional Name: 1-(1-phenylethyl)-3-piperonyl-thiourea Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H18N2O2S/c1-12(14-5-3-2-4-6-14)19-17(22)18-10-13-7-8-15-16(9-13)21-11-20-15/h2-9,12H,10-11H2,1H3,(H2,18,19,22)