N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[2-[(4-ethylphenyl)methyl]-3-pyrazolyl]-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-[2-(4-ethylbenzyl)pyrazol-3-yl]-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C23H25N5O4S MolecularWeight: 467.5407

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCNC(=O)C4

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCNC(=O)C4

InChI

InChI=1S/C23H25N5O4S/c1-2-17-6-8-18(9-7-17)15-28-21(10-11-25-28)26-23(30)19-4-3-5-20(14-19)33(31,32)27-13-12-24-22(29)16-27/h3-11,14H,2,12-13,15-16H2,1H3,(H,24,29)(H,26,30)