1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(2-methylphenyl)thiourea

Systemtic Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(2-methylphenyl)thiourea Openeye Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(o-tolyl)thiourea CAS Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(2-methylphenyl)thiourea IUPAC Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(2-methylphenyl)thiourea Traditional Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(o-tolyl)thiourea Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NC(C)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NC(C)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H18N2O2S/c1-11-5-3-4-6-14(11)19-17(22)18-12(2)13-7-8-15-16(9-13)21-10-20-15/h3-9,12H,10H2,1-2H3,(H2,18,19,22)