1-(1,3-benzodioxol-5-yl)-3-[1-(2,6-dimethylphenoxy)propan-2-yl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[1-(2,6-dimethylphenoxy)propan-2-yl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(2,6-dimethylphenoxy)-1-methyl-ethyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[1-(2,6-dimethylphenoxy)propan-2-yl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[1-(2,6-dimethylphenoxy)propan-2-yl]thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(2,6-dimethylphenoxy)-1-methyl-ethyl]thiourea Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O3S/c1-12-5-4-6-13(2)18(12)22-10-14(3)20-19(25)21-15-7-8-16-17(9-15)24-11-23-16/h4-9,14H,10-11H2,1-3H3,(H2,20,21,25)