2-(2-azanylidene-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)-1-(4-methoxyphenyl)ethanone bromide

Systemtic Name: 2-(2-azanylidene-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)-1-(4-methoxyphenyl)ethanone bromide Openeye Name: 2-(2-imino-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)-1-(4-methoxyphenyl)ethanone bromide CAS Name: 2-(2-imino-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)-1-(4-methoxyphenyl)ethanone bromide IUPAC Name: 2-(2-imino-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)-1-(4-methoxyphenyl)ethanone bromide Traditional Name: 2-(2-imino-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)-1-(4-methoxyphenyl)ethanone bromide Formula: C16H18BrN2O2S- MolecularWeight: 382.29532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CN2C3=C(CCCC3)SC2=N.[Br-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CN2C3=C(CCCC3)SC2=N.[Br-]

InChI

InChI=1S/C16H18N2O2S.BrH/c1-20-12-8-6-11(7-9-12)14(19)10-18-13-4-2-3-5-15(13)21-16(18)17;/h6-9,17H,2-5,10H2,1H3;1H/p-1