1-(1,3-benzodioxol-5-ylmethyl)-3-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]thiourea Traditional Name: 1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-3-piperonyl-thiourea Formula: C15H20N2O4S MolecularWeight: 324.3953

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)CNC(=S)NCC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CC1(OCC(O1)CNC(=S)NCC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C15H20N2O4S/c1-15(2)20-8-11(21-15)7-17-14(22)16-6-10-3-4-12-13(5-10)19-9-18-12/h3-5,11H,6-9H2,1-2H3,(H2,16,17,22)