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

Systemtic Name: N-[3-[4-(3-methylpyridin-4-yl)piperazin-1-yl]-3-oxidanylidene-propyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[3-[4-(3-methyl-4-pyridyl)piperazin-1-yl]-3-oxo-propyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[3-[4-(3-methyl-4-pyridinyl)-1-piperazinyl]-3-oxopropyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[3-[4-(3-methylpyridin-4-yl)piperazin-1-yl]-3-oxopropyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[3-keto-3-[4-(3-methyl-4-pyridyl)piperazino]propyl]piazthiole-4-sulfonamide Formula: C19H22N6O3S2 MolecularWeight: 446.54638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1)N2CCN(CC2)C(=O)CCNS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CC1=C(C=CN=C1)N2CCN(CC2)C(=O)CCNS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C19H22N6O3S2/c1-14-13-20-7-5-16(14)24-9-11-25(12-10-24)18(26)6-8-21-30(27,28)17-4-2-3-15-19(17)23-29-22-15/h2-5,7,13,21H,6,8-12H2,1H3