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

Systemtic Name: 1-cyano-3-[(E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enyl]thiourea Openeye Name: 1-cyano-3-[(E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)allyl]thiourea CAS Name: 1-cyano-3-[(E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enyl]thiourea IUPAC Name: 1-cyano-3-[(E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enyl]thiourea Traditional Name: 1-cyano-3-[(E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)allyl]thiourea Formula: C13H13N3O2S MolecularWeight: 275.32622

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C=CCNC(=S)NC#N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)/C=C/CNC(=S)NC#N

InChI

InChI=1S/C13H13N3O2S/c14-9-16-13(19)15-5-1-2-10-3-4-11-12(8-10)18-7-6-17-11/h1-4,8H,5-7H2,(H2,15,16,19)/b2-1+