1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-propan-2-yl-1-[(2-prop-2-enoxyphenyl)methyl]thiourea

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-propan-2-yl-1-[(2-prop-2-enoxyphenyl)methyl]thiourea Openeye Name: 1-[(2-allyloxyphenyl)methyl]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-isopropyl-thiourea CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-propan-2-yl-1-[(2-prop-2-enoxyphenyl)methyl]thiourea IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-propan-2-yl-1-[(2-prop-2-enoxyphenyl)methyl]thiourea Traditional Name: 1-(2-allyloxybenzyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-isopropyl-thiourea Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)N(CC1=CC=CC=C1OCC=C)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C)NC(=S)N(CC1=CC=CC=C1OCC=C)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C22H26N2O3S/c1-4-11-25-19-8-6-5-7-17(19)15-24(22(28)23-16(2)3)18-9-10-20-21(14-18)27-13-12-26-20/h4-10,14,16H,1,11-13,15H2,2-3H3,(H,23,28)