1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(E)-3-phenylprop-2-enyl]-3-prop-2-enyl-thiourea

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(E)-3-phenylprop-2-enyl]-3-prop-2-enyl-thiourea Openeye Name: 3-allyl-1-[(E)-cinnamyl]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(E)-3-phenylprop-2-enyl]-3-prop-2-enylthiourea IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(E)-3-phenylprop-2-enyl]-3-prop-2-enylthiourea Traditional Name: 3-allyl-1-[(E)-cinnamyl]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)N(CC=CC1=CC=CC=C1)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C=CCNC(=S)N(C/C=C/C1=CC=CC=C1)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H22N2O2S/c1-2-12-22-21(26)23(13-6-9-17-7-4-3-5-8-17)18-10-11-19-20(16-18)25-15-14-24-19/h2-11,16H,1,12-15H2,(H,22,26)/b9-6+