1-(1,3-benzodioxol-5-yl)-3-ethyl-1-[(2-prop-2-enoxyphenyl)methyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-ethyl-1-[(2-prop-2-enoxyphenyl)methyl]thiourea Openeye Name: 1-[(2-allyloxyphenyl)methyl]-1-(1,3-benzodioxol-5-yl)-3-ethyl-thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-ethyl-1-[(2-prop-2-enoxyphenyl)methyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-ethyl-1-[(2-prop-2-enoxyphenyl)methyl]thiourea Traditional Name: 1-(2-allyloxybenzyl)-1-(1,3-benzodioxol-5-yl)-3-ethyl-thiourea Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N(CC1=CC=CC=C1OCC=C)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCNC(=S)N(CC1=CC=CC=C1OCC=C)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H22N2O3S/c1-3-11-23-17-8-6-5-7-15(17)13-22(20(26)21-4-2)16-9-10-18-19(12-16)25-14-24-18/h3,5-10,12H,1,4,11,13-14H2,2H3,(H,21,26)