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

Systemtic Name: 1-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-ethyl-thiourea Openeye Name: 1-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-ethyl-thiourea CAS Name: 1-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-ethylthiourea IUPAC Name: 1-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-ethylthiourea Traditional Name: 1-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-ethyl-thiourea Formula: C13H17ClN2O2S MolecularWeight: 300.80428

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NCC1=CC2=C(C(=C1)Cl)OCCCO2

Isomeric SMILES

CCNC(=S)NCC1=CC2=C(C(=C1)Cl)OCCCO2

InChI

InChI=1S/C13H17ClN2O2S/c1-2-15-13(19)16-8-9-6-10(14)12-11(7-9)17-4-3-5-18-12/h6-7H,2-5,8H2,1H3,(H2,15,16,19)