N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[4-(4-fluorophenyl)-5-methyl-thiazol-2-yl]-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[4-(4-fluorophenyl)-5-methyl-2-thiazolyl]-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-[4-(4-fluorophenyl)-5-methyl-thiazol-2-yl]-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C21H19FN4O4S2 MolecularWeight: 474.528363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H19FN4O4S2/c1-13-19(14-5-7-16(22)8-6-14)24-21(31-13)25-20(28)15-3-2-4-17(11-15)32(29,30)26-10-9-23-18(27)12-26/h2-8,11H,9-10,12H2,1H3,(H,23,27)(H,24,25,28)