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

Systemtic Name: 1-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino]thiourea CAS Name: 1-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino]thiourea Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NN=CC1=CC2=C(C=C1)OCCO2

Isomeric SMILES

C=CCNC(=S)N/N=C/C1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C13H15N3O2S/c1-2-5-14-13(19)16-15-9-10-3-4-11-12(8-10)18-7-6-17-11/h2-4,8-9H,1,5-7H2,(H2,14,16,19)/b15-9+