[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-[4-(1,3-dithian-2-yl)phenyl]methanone

Systemtic Name: [4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-[4-(1,3-dithian-2-yl)phenyl]methanone Openeye Name: [4-(5-bromo-2-pyridyl)piperazin-1-yl]-[4-(1,3-dithian-2-yl)phenyl]methanone CAS Name: [4-(5-bromo-2-pyridinyl)-1-piperazinyl]-[4-(1,3-dithian-2-yl)phenyl]methanone IUPAC Name: [4-(5-bromopyridin-2-yl)piperazin-1-yl]-[4-(1,3-dithian-2-yl)phenyl]methanone Traditional Name: [4-(5-bromo-2-pyridyl)piperazino]-[4-(1,3-dithian-2-yl)phenyl]methanone Formula: C20H22BrN3OS2 MolecularWeight: 464.44218

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC=C(C=C4)Br

Isomeric SMILES

C1CSC(SC1)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC=C(C=C4)Br

InChI

InChI=1S/C20H22BrN3OS2/c21-17-6-7-18(22-14-17)23-8-10-24(11-9-23)19(25)15-2-4-16(5-3-15)20-26-12-1-13-27-20/h2-7,14,20H,1,8-13H2