1-(2-cyanoethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-thiourea

Systemtic Name: 1-(2-cyanoethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-thiourea Openeye Name: 1-(2-cyanoethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-thiourea CAS Name: 1-(2-cyanoethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methylthiourea IUPAC Name: 1-(2-cyanoethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methylthiourea Traditional Name: 1-(2-cyanoethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-thiourea Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=S)NC1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CN(CCC#N)C(=S)NC1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C13H15N3O2S/c1-16(6-2-5-14)13(19)15-10-3-4-11-12(9-10)18-8-7-17-11/h3-4,9H,2,6-8H2,1H3,(H,15,19)