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

Systemtic Name: 1-(2-cyclohexylethanoylamino)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea Openeye Name: 1-[(2-cyclohexylacetyl)amino]-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea CAS Name: 1-[(2-cyclohexyl-1-oxoethyl)amino]-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea IUPAC Name: 1-[(2-cyclohexylacetyl)amino]-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea Traditional Name: 1-[(2-cyclohexylacetyl)amino]-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(=O)NNC(=S)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C1CCC(CC1)CC(=O)NNC(=S)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C17H23N3O3S/c21-16(10-12-4-2-1-3-5-12)19-20-17(24)18-13-6-7-14-15(11-13)23-9-8-22-14/h6-7,11-12H,1-5,8-10H2,(H,19,21)(H2,18,20,24)