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

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-methyl-1-[(2-prop-2-enoxyphenyl)methyl]thiourea Openeye Name: 1-[(2-allyloxyphenyl)methyl]-1-(1,3-benzodioxol-5-yl)-3-methyl-thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-methyl-1-[(2-prop-2-enoxyphenyl)methyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-methyl-1-[(2-prop-2-enoxyphenyl)methyl]thiourea Traditional Name: 1-(2-allyloxybenzyl)-1-(1,3-benzodioxol-5-yl)-3-methyl-thiourea Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O3S/c1-3-10-22-16-7-5-4-6-14(16)12-21(19(25)20-2)15-8-9-17-18(11-15)24-13-23-17/h3-9,11H,1,10,12-13H2,2H3,(H,20,25)