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

Systemtic Name: 1-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-3-methyl-thiourea Openeye Name: 1-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino]-3-methyl-thiourea CAS Name: 1-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-3-methylthiourea IUPAC Name: 1-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-3-methylthiourea Traditional Name: 1-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino]-3-methyl-thiourea Formula: C11H13N3O2S MolecularWeight: 251.30482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O2S/c1-12-11(17)14-13-7-8-2-3-9-10(6-8)16-5-4-15-9/h2-3,6-7H,4-5H2,1H3,(H2,12,14,17)/b13-7+