2-bromanyl-5-[(3S)-1-(phenylsulfonyl)piperidin-3-yl]-1,3,4-thiadiazole

Systemtic Name: 2-bromanyl-5-[(3S)-1-(phenylsulfonyl)piperidin-3-yl]-1,3,4-thiadiazole Openeye Name: 2-[(3S)-1-(benzenesulfonyl)-3-piperidyl]-5-bromo-1,3,4-thiadiazole CAS Name: 2-[(3S)-1-(benzenesulfonyl)-3-piperidinyl]-5-bromo-1,3,4-thiadiazole IUPAC Name: 2-[(3S)-1-(benzenesulfonyl)piperidin-3-yl]-5-bromo-1,3,4-thiadiazole Traditional Name: 2-[(3S)-1-besyl-3-piperidyl]-5-bromo-1,3,4-thiadiazole Formula: C13H14BrN3O2S2 MolecularWeight: 388.30316

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C3=NN=C(S3)Br

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CC=C2)C3=NN=C(S3)Br

InChI

InChI=1S/C13H14BrN3O2S2/c14-13-16-15-12(20-13)10-5-4-8-17(9-10)21(18,19)11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2/t10-/m0/s1