1-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonylamino)-3-(2-phenylsulfanylethyl)thiourea

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonylamino)-3-(2-phenylsulfanylethyl)thiourea Openeye Name: 1-(2,3-dihydro-1,4-benzodioxine-3-carbonylamino)-3-(2-phenylsulfanylethyl)thiourea CAS Name: 1-[[2,3-dihydro-1,4-benzodioxin-3-yl(oxo)methyl]amino]-3-[2-(phenylthio)ethyl]thiourea IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxine-3-carbonylamino)-3-(2-phenylsulfanylethyl)thiourea Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-3-carbonylamino)-3-[2-(phenylthio)ethyl]thiourea Formula: C18H19N3O3S2 MolecularWeight: 389.49176

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)NNC(=S)NCCSC3=CC=CC=C3

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)C(=O)NNC(=S)NCCSC3=CC=CC=C3

InChI

InChI=1S/C18H19N3O3S2/c22-17(16-12-23-14-8-4-5-9-15(14)24-16)20-21-18(25)19-10-11-26-13-6-2-1-3-7-13/h1-9,16H,10-12H2,(H,20,22)(H2,19,21,25)