1-(1,3-benzodioxol-5-ylmethyl)-3-(4-ethoxy-3-methoxy-phenyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-ethoxy-3-methoxy-phenyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-ethoxy-3-methoxy-phenyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-ethoxy-3-methoxyphenyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-ethoxy-3-methoxyphenyl)thiourea Traditional Name: 1-(4-ethoxy-3-methoxy-phenyl)-3-piperonyl-thiourea Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=S)NCC2=CC3=C(C=C2)OCO3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=S)NCC2=CC3=C(C=C2)OCO3)OC

InChI

InChI=1S/C18H20N2O4S/c1-3-22-14-7-5-13(9-16(14)21-2)20-18(25)19-10-12-4-6-15-17(8-12)24-11-23-15/h4-9H,3,10-11H2,1-2H3,(H2,19,20,25)