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

Systemtic Name: 1-cyclohexyl-3-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonylamino)thiourea Openeye Name: 1-cyclohexyl-3-(2,3-dihydro-1,4-benzodioxine-3-carbonylamino)thiourea CAS Name: 1-cyclohexyl-3-[[2,3-dihydro-1,4-benzodioxin-3-yl(oxo)methyl]amino]thiourea IUPAC Name: 1-cyclohexyl-3-(2,3-dihydro-1,4-benzodioxine-3-carbonylamino)thiourea Traditional Name: 1-cyclohexyl-3-(2,3-dihydro-1,4-benzodioxin-3-carbonylamino)thiourea Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NNC(=O)C2COC3=CC=CC=C3O2

Isomeric SMILES

C1CCC(CC1)NC(=S)NNC(=O)C2COC3=CC=CC=C3O2

InChI

InChI=1S/C16H21N3O3S/c20-15(14-10-21-12-8-4-5-9-13(12)22-14)18-19-16(23)17-11-6-2-1-3-7-11/h4-5,8-9,11,14H,1-3,6-7,10H2,(H,18,20)(H2,17,19,23)