1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(2,3-dimethoxyphenyl)ethyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(2,3-dimethoxyphenyl)ethyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(2,3-dimethoxyphenyl)ethyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(2,3-dimethoxyphenyl)ethyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(2,3-dimethoxyphenyl)ethyl]thiourea Traditional Name: 1-[2-(2,3-dimethoxyphenyl)ethyl]-3-piperonyl-thiourea Formula: C19H22N2O4S MolecularWeight: 374.45398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CCNC(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC1=CC=CC(=C1OC)CCNC(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H22N2O4S/c1-22-16-5-3-4-14(18(16)23-2)8-9-20-19(26)21-11-13-6-7-15-17(10-13)25-12-24-15/h3-7,10H,8-9,11-12H2,1-2H3,(H2,20,21,26)