[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(5-bromanylpyridin-3-yl)methanone

Systemtic Name: [2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(5-bromanylpyridin-3-yl)methanone Openeye Name: [2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(5-bromo-3-pyridyl)methanone CAS Name: [2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-(5-bromo-3-pyridinyl)methanone IUPAC Name: [2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(5-bromopyridin-3-yl)methanone Traditional Name: [2-(1,3-benzothiazol-2-yl)pyrrolidino]-(5-bromo-3-pyridyl)methanone Formula: C17H14BrN3OS MolecularWeight: 388.28156

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC(=CN=C2)Br)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC(N(C1)C(=O)C2=CC(=CN=C2)Br)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H14BrN3OS/c18-12-8-11(9-19-10-12)17(22)21-7-3-5-14(21)16-20-13-4-1-2-6-15(13)23-16/h1-2,4,6,8-10,14H,3,5,7H2