1-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-cyclohexyl-thiourea

Systemtic Name: 1-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-cyclohexyl-thiourea Openeye Name: 1-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-cyclohexyl-thiourea CAS Name: 1-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-cyclohexylthiourea IUPAC Name: 1-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-cyclohexylthiourea Traditional Name: 1-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-cyclohexyl-thiourea Formula: C17H23ClN2O2S MolecularWeight: 354.89472

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NCC2=CC3=C(C(=C2)Cl)OCCCO3

Isomeric SMILES

C1CCC(CC1)NC(=S)NCC2=CC3=C(C(=C2)Cl)OCCCO3

InChI

InChI=1S/C17H23ClN2O2S/c18-14-9-12(10-15-16(14)22-8-4-7-21-15)11-19-17(23)20-13-5-2-1-3-6-13/h9-10,13H,1-8,11H2,(H2,19,20,23)