5-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfanyl]-4-methyl-1,3-thiazol-2-amine

Systemtic Name: 5-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfanyl]-4-methyl-1,3-thiazol-2-amine Openeye Name: 5-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfanyl]-4-methyl-thiazol-2-amine CAS Name: 5-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylthio]-4-methyl-2-thiazolamine IUPAC Name: 5-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfanyl]-4-methyl-1,3-thiazol-2-amine Traditional Name: [5-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylthio]-4-methyl-thiazol-2-yl]amine Formula: C14H15ClN2O2S2 MolecularWeight: 342.8641

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N)SCC2=CC3=C(C(=C2)Cl)OCCCO3

Isomeric SMILES

CC1=C(SC(=N1)N)SCC2=CC3=C(C(=C2)Cl)OCCCO3

InChI

InChI=1S/C14H15ClN2O2S2/c1-8-13(21-14(16)17-8)20-7-9-5-10(15)12-11(6-9)18-3-2-4-19-12/h5-6H,2-4,7H2,1H3,(H2,16,17)