1-(1,3-benzodioxol-5-yl)-3-[2-(2,4-dimethylphenyl)ethyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(2,4-dimethylphenyl)ethyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(2,4-dimethylphenyl)ethyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(2,4-dimethylphenyl)ethyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(2,4-dimethylphenyl)ethyl]thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(2,4-dimethylphenyl)ethyl]thiourea Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CCNC(=S)NC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CC1=CC(=C(C=C1)CCNC(=S)NC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C18H20N2O2S/c1-12-3-4-14(13(2)9-12)7-8-19-18(23)20-15-5-6-16-17(10-15)22-11-21-16/h3-6,9-10H,7-8,11H2,1-2H3,(H2,19,20,23)