N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-1-phenyl-ethyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-1-phenyl-ethyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxo-1-phenyl-ethyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[2-[4-(4-fluorophenyl)-1-piperazinyl]-2-oxo-1-phenylethyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxo-1-phenylethyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[2-[4-(4-fluorophenyl)piperazino]-2-keto-1-phenyl-ethyl]piazthiole-4-sulfonamide Formula: C24H22FN5O3S2 MolecularWeight: 511.591583

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)C(C3=CC=CC=C3)NS(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)C(C3=CC=CC=C3)NS(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C24H22FN5O3S2/c25-18-9-11-19(12-10-18)29-13-15-30(16-14-29)24(31)22(17-5-2-1-3-6-17)28-35(32,33)21-8-4-7-20-23(21)27-34-26-20/h1-12,22,28H,13-16H2