3-(1,3-benzodioxol-5-ylmethyl)-1-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-1-methyl-thiourea

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-1-methyl-thiourea Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-1-methyl-thiourea CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-[(4,5-dimethoxy-2-methylphenyl)methyl]-1-methylthiourea IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-[(4,5-dimethoxy-2-methylphenyl)methyl]-1-methylthiourea Traditional Name: 1-(4,5-dimethoxy-2-methyl-benzyl)-1-methyl-3-piperonyl-thiourea Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN(C)C(=S)NCC2=CC3=C(C=C2)OCO3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN(C)C(=S)NCC2=CC3=C(C=C2)OCO3)OC)OC

InChI

InChI=1S/C20H24N2O4S/c1-13-7-17(23-3)18(24-4)9-15(13)11-22(2)20(27)21-10-14-5-6-16-19(8-14)26-12-25-16/h5-9H,10-12H2,1-4H3,(H,21,27)