1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(4-methoxyphenoxy)ethyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(4-methoxyphenoxy)ethyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(4-methoxyphenoxy)ethyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(4-methoxyphenoxy)ethyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(4-methoxyphenoxy)ethyl]thiourea Traditional Name: 1-[2-(4-methoxyphenoxy)ethyl]-3-piperonyl-thiourea Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCNC(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC1=CC=C(C=C1)OCCNC(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H20N2O4S/c1-21-14-3-5-15(6-4-14)22-9-8-19-18(25)20-11-13-2-7-16-17(10-13)24-12-23-16/h2-7,10H,8-9,11-12H2,1H3,(H2,19,20,25)