[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(3-fluoranyl-4-methyl-phenyl)methanone

Systemtic Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(3-fluoranyl-4-methyl-phenyl)methanone Openeye Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(3-fluoro-4-methyl-phenyl)methanone CAS Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]-(3-fluoro-4-methylphenyl)methanone IUPAC Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(3-fluoro-4-methylphenyl)methanone Traditional Name: (3-fluoro-4-methyl-phenyl)-(4-piazthiol-4-ylsulfonylpiperazino)methanone Formula: C18H17FN4O3S2 MolecularWeight: 420.480983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43)F

InChI

InChI=1S/C18H17FN4O3S2/c1-12-5-6-13(11-14(12)19)18(24)22-7-9-23(10-8-22)28(25,26)16-4-2-3-15-17(16)21-27-20-15/h2-6,11H,7-10H2,1H3