N-[3-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-3-oxidanylidene-propyl]-2,1,3-benzoxadiazole-4-sulfonamide

Systemtic Name: N-[3-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-3-oxidanylidene-propyl]-2,1,3-benzoxadiazole-4-sulfonamide Openeye Name: N-[3-[4-(5-bromo-2-pyridyl)piperazin-1-yl]-3-oxo-propyl]-2,1,3-benzoxadiazole-4-sulfonamide CAS Name: N-[3-[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-3-oxopropyl]-2,1,3-benzoxadiazole-4-sulfonamide IUPAC Name: N-[3-[4-(5-bromopyridin-2-yl)piperazin-1-yl]-3-oxopropyl]-2,1,3-benzoxadiazole-4-sulfonamide Traditional Name: N-[3-[4-(5-bromo-2-pyridyl)piperazino]-3-keto-propyl]benzofurazan-4-sulfonamide Formula: C18H19BrN6O4S MolecularWeight: 495.35026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)Br)C(=O)CCNS(=O)(=O)C3=CC=CC4=NON=C43

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)Br)C(=O)CCNS(=O)(=O)C3=CC=CC4=NON=C43

InChI

InChI=1S/C18H19BrN6O4S/c19-13-4-5-16(20-12-13)24-8-10-25(11-9-24)17(26)6-7-21-30(27,28)15-3-1-2-14-18(15)23-29-22-14/h1-5,12,21H,6-11H2