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

Systemtic Name: 1-(2-cyanoethyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-ethyl-thiourea Openeye Name: 1-(2-cyanoethyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-ethyl-thiourea CAS Name: 1-(2-cyanoethyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-ethylthiourea IUPAC Name: 1-(2-cyanoethyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-ethylthiourea Traditional Name: 1-(2-cyanoethyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-ethyl-thiourea Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N(CCC#N)C1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CCNC(=S)N(CCC#N)C1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C14H17N3O2S/c1-2-16-14(20)17(7-3-6-15)11-4-5-12-13(10-11)19-9-8-18-12/h4-5,10H,2-3,7-9H2,1H3,(H,16,20)