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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)NC(=S)NC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)NC(=S)NC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C18H20N2O2S/c1-11-4-5-14(8-12(11)2)13(3)19-18(23)20-15-6-7-16-17(9-15)22-10-21-16/h4-9,13H,10H2,1-3H3,(H2,19,20,23)