2-(2-azanyl-4-bromanyl-phenyl)sulfanyl-1-(azetidin-1-yl)ethanone

Systemtic Name: 2-(2-azanyl-4-bromanyl-phenyl)sulfanyl-1-(azetidin-1-yl)ethanone Openeye Name: 2-(2-amino-4-bromo-phenyl)sulfanyl-1-(azetidin-1-yl)ethanone CAS Name: 2-[(2-amino-4-bromophenyl)thio]-1-(1-azetidinyl)ethanone IUPAC Name: 2-(2-amino-4-bromophenyl)sulfanyl-1-(azetidin-1-yl)ethanone Traditional Name: 2-[(2-amino-4-bromo-phenyl)thio]-1-(azetidin-1-yl)ethanone Formula: C11H13BrN2OS MolecularWeight: 301.20272

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1)C(=O)CSC2=C(C=C(C=C2)Br)N

Isomeric SMILES

C1CN(C1)C(=O)CSC2=C(C=C(C=C2)Br)N

InChI

InChI=1S/C11H13BrN2OS/c12-8-2-3-10(9(13)6-8)16-7-11(15)14-4-1-5-14/h2-3,6H,1,4-5,7,13H2