1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-phenethyl-thiourea

Systemtic Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-phenethyl-thiourea Openeye Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-phenethyl-thiourea CAS Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-phenethylthiourea IUPAC Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-phenethylthiourea Traditional Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-phenethyl-thiourea Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=S)NCCC3=CC=CC=C3

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C18H20N2O2S/c1-13(15-7-8-16-17(11-15)22-12-21-16)20-18(23)19-10-9-14-5-3-2-4-6-14/h2-8,11,13H,9-10,12H2,1H3,(H2,19,20,23)