(5-bromanylpyridin-3-yl)-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,4-diazepan-1-yl]methanone

Systemtic Name: (5-bromanylpyridin-3-yl)-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (5-bromo-3-pyridyl)-[4-[(2-methylthiazol-4-yl)methyl]-1,4-diazepan-1-yl]methanone CAS Name: (5-bromo-3-pyridinyl)-[4-[(2-methyl-4-thiazolyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (5-bromopyridin-3-yl)-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: (5-bromo-3-pyridyl)-[4-[(2-methylthiazol-4-yl)methyl]-1,4-diazepan-1-yl]methanone Formula: C16H19BrN4OS MolecularWeight: 395.31726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CN2CCCN(CC2)C(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

CC1=NC(=CS1)CN2CCCN(CC2)C(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C16H19BrN4OS/c1-12-19-15(11-23-12)10-20-3-2-4-21(6-5-20)16(22)13-7-14(17)9-18-8-13/h7-9,11H,2-6,10H2,1H3