4-(7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-methyl-1,3-thiazol-2-amine

Systemtic Name: 4-(7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-methyl-1,3-thiazol-2-amine Openeye Name: 4-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-methyl-thiazol-2-amine CAS Name: 4-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-methyl-2-thiazolamine IUPAC Name: 4-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-methyl-1,3-thiazol-2-amine Traditional Name: [4-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-methyl-thiazol-2-yl]amine Formula: C13H13BrN2O2S MolecularWeight: 341.22352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)N)C2=CC3=C(C=C2Br)OCCCO3

Isomeric SMILES

CC1=C(N=C(S1)N)C2=CC3=C(C=C2Br)OCCCO3

InChI

InChI=1S/C13H13BrN2O2S/c1-7-12(16-13(15)19-7)8-5-10-11(6-9(8)14)18-4-2-3-17-10/h5-6H,2-4H2,1H3,(H2,15,16)