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

Systemtic Name: 3-(4-ethanoylpiperazin-1-yl)sulfonyl-N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]benzamide Openeye Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]benzamide CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]-N-[2-[(4-ethylphenyl)methyl]-3-pyrazolyl]benzamide IUPAC Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]benzamide Traditional Name: 3-(4-acetylpiperazino)sulfonyl-N-[2-(4-ethylbenzyl)pyrazol-3-yl]benzamide Formula: C25H29N5O4S MolecularWeight: 495.59386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C(=O)C

InChI

InChI=1S/C25H29N5O4S/c1-3-20-7-9-21(10-8-20)18-30-24(11-12-26-30)27-25(32)22-5-4-6-23(17-22)35(33,34)29-15-13-28(14-16-29)19(2)31/h4-12,17H,3,13-16,18H2,1-2H3,(H,27,32)