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

Systemtic Name: 1-(3-cyclohexylpropanoylamino)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea Openeye Name: 1-(3-cyclohexylpropanoylamino)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea CAS Name: 1-[(3-cyclohexyl-1-oxopropyl)amino]-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea IUPAC Name: 1-(3-cyclohexylpropanoylamino)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea Traditional Name: 1-(3-cyclohexylpropanoylamino)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea Formula: C18H25N3O3S MolecularWeight: 363.4744

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3O3S/c22-17(9-6-13-4-2-1-3-5-13)20-21-18(25)19-14-7-8-15-16(12-14)24-11-10-23-15/h7-8,12-13H,1-6,9-11H2,(H,20,22)(H2,19,21,25)