2-(2-azanylidene-5-heptyl-1,3-thiazol-3-yl)-1-phenyl-ethanone hydrobromide

Systemtic Name: 2-(2-azanylidene-5-heptyl-1,3-thiazol-3-yl)-1-phenyl-ethanone hydrobromide Openeye Name: 2-(5-heptyl-2-imino-thiazol-3-yl)-1-phenyl-ethanone hydrobromide CAS Name: 2-(5-heptyl-2-imino-3-thiazolyl)-1-phenylethanone hydrobromide IUPAC Name: 2-(5-heptyl-2-imino-1,3-thiazol-3-yl)-1-phenylethanone hydrobromide Traditional Name: 2-(5-heptyl-2-imino-4-thiazolin-3-yl)-1-phenyl-ethanone hydrobromide Formula: C18H25BrN2OS MolecularWeight: 397.3729

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN(C(=N)S1)CC(=O)C2=CC=CC=C2.Br

Isomeric SMILES

CCCCCCCC1=CN(C(=N)S1)CC(=O)C2=CC=CC=C2.Br

InChI

InChI=1S/C18H24N2OS.BrH/c1-2-3-4-5-9-12-16-13-20(18(19)22-16)14-17(21)15-10-7-6-8-11-15;/h6-8,10-11,13,19H,2-5,9,12,14H2,1H3;1H