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

Systemtic Name: N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[4-(2,4-dimethylphenyl)thiazol-2-yl]-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[4-(2,4-dimethylphenyl)-2-thiazolyl]-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-[4-(2,4-dimethylphenyl)thiazol-2-yl]-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C22H22N4O4S2 MolecularWeight: 470.56448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCNC(=O)C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCNC(=O)C4)C

InChI

InChI=1S/C22H22N4O4S2/c1-14-6-7-18(15(2)10-14)19-13-31-22(24-19)25-21(28)16-4-3-5-17(11-16)32(29,30)26-9-8-23-20(27)12-26/h3-7,10-11,13H,8-9,12H2,1-2H3,(H,23,27)(H,24,25,28)