N-[3-[4-(4-chloranylpyridin-2-yl)piperazin-1-yl]-3-oxidanylidene-propyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[3-[4-(4-chloranylpyridin-2-yl)piperazin-1-yl]-3-oxidanylidene-propyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[3-[4-(4-chloro-2-pyridyl)piperazin-1-yl]-3-oxo-propyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[3-[4-(4-chloro-2-pyridinyl)-1-piperazinyl]-3-oxopropyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[3-[4-(4-chloropyridin-2-yl)piperazin-1-yl]-3-oxopropyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[3-[4-(4-chloro-2-pyridyl)piperazino]-3-keto-propyl]piazthiole-4-sulfonamide Formula: C18H19ClN6O3S2 MolecularWeight: 466.96486

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC(=C2)Cl)C(=O)CCNS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1CN(CCN1C2=NC=CC(=C2)Cl)C(=O)CCNS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C18H19ClN6O3S2/c19-13-4-6-20-16(12-13)24-8-10-25(11-9-24)17(26)5-7-21-30(27,28)15-3-1-2-14-18(15)23-29-22-14/h1-4,6,12,21H,5,7-11H2