1-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-(4-bromophenyl)sulfanyl-ethanone

Systemtic Name: 1-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-(4-bromophenyl)sulfanyl-ethanone Openeye Name: 1-[3-(1,3-benzoxazol-2-yl)-1-piperidyl]-2-(4-bromophenyl)sulfanyl-ethanone CAS Name: 1-[3-(1,3-benzoxazol-2-yl)-1-piperidinyl]-2-[(4-bromophenyl)thio]ethanone IUPAC Name: 1-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-(4-bromophenyl)sulfanylethanone Traditional Name: 1-[3-(1,3-benzoxazol-2-yl)piperidino]-2-[(4-bromophenyl)thio]ethanone Formula: C20H19BrN2O2S MolecularWeight: 431.34606

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CSC2=CC=C(C=C2)Br)C3=NC4=CC=CC=C4O3

Isomeric SMILES

C1CC(CN(C1)C(=O)CSC2=CC=C(C=C2)Br)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C20H19BrN2O2S/c21-15-7-9-16(10-8-15)26-13-19(24)23-11-3-4-14(12-23)20-22-17-5-1-2-6-18(17)25-20/h1-2,5-10,14H,3-4,11-13H2