(3-bromanyl-2-fluoranyl-phenyl)-[4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (3-bromanyl-2-fluoranyl-phenyl)-[4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (3-bromo-2-fluoro-phenyl)-[4-(thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (3-bromo-2-fluorophenyl)-[4-(2-thiazolylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (3-bromo-2-fluorophenyl)-[4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: (3-bromo-2-fluoro-phenyl)-[4-(thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone Formula: C16H17BrFN3OS MolecularWeight: 398.293083

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=C(C(=CC=C2)Br)F)CC3=NC=CS3

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=C(C(=CC=C2)Br)F)CC3=NC=CS3

InChI

InChI=1S/C16H17BrFN3OS/c17-13-4-1-3-12(15(13)18)16(22)21-7-2-6-20(8-9-21)11-14-19-5-10-23-14/h1,3-5,10H,2,6-9,11H2