2-[(3-bromophenyl)methylsulfanyl]-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[(3-bromophenyl)methylsulfanyl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[(3-bromophenyl)methylsulfanyl]-1-morpholino-ethanone CAS Name: 2-[(3-bromophenyl)methylthio]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[(3-bromophenyl)methylsulfanyl]-1-morpholin-4-ylethanone Traditional Name: 2-[(3-bromobenzyl)thio]-1-morpholino-ethanone Formula: C13H16BrNO2S MolecularWeight: 330.24064

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CSCC2=CC(=CC=C2)Br

Isomeric SMILES

C1COCCN1C(=O)CSCC2=CC(=CC=C2)Br

InChI

InChI=1S/C13H16BrNO2S/c14-12-3-1-2-11(8-12)9-18-10-13(16)15-4-6-17-7-5-15/h1-3,8H,4-7,9-10H2