1-methyl-N-(4-phenyl-1,3-thiazol-2-yl)azepan-2-imine

Systemtic Name: 1-methyl-N-(4-phenyl-1,3-thiazol-2-yl)azepan-2-imine Openeye Name: 1-methyl-N-(4-phenylthiazol-2-yl)azepan-2-imine CAS Name: 1-methyl-N-(4-phenyl-2-thiazolyl)-2-azepanimine IUPAC Name: 1-methyl-N-(4-phenyl-1,3-thiazol-2-yl)azepan-2-imine Traditional Name: (Z)-(1-methylazepan-2-ylidene)-(4-phenylthiazol-2-yl)amine Formula: C16H19N3S MolecularWeight: 285.40716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCCCC1=NC2=NC(=CS2)C3=CC=CC=C3

Isomeric SMILES

CN\1CCCCC/C1=N/C2=NC(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C16H19N3S/c1-19-11-7-3-6-10-15(19)18-16-17-14(12-20-16)13-8-4-2-5-9-13/h2,4-5,8-9,12H,3,6-7,10-11H2,1H3/b18-15-