N-[2-(cyclohexen-1-yl)ethyl]-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-[2-(cyclohexen-1-yl)ethyl]benzamide CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]-N-[2-(1-cyclohexenyl)ethyl]benzamide IUPAC Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-[2-(cyclohexen-1-yl)ethyl]benzamide Traditional Name: 3-(4-acetylpiperazino)sulfonyl-N-[2-(cyclohexen-1-yl)ethyl]benzamide Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCCC3=CCCCC3

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCCC3=CCCCC3

InChI

InChI=1S/C21H29N3O4S/c1-17(25)23-12-14-24(15-13-23)29(27,28)20-9-5-8-19(16-20)21(26)22-11-10-18-6-3-2-4-7-18/h5-6,8-9,16H,2-4,7,10-15H2,1H3,(H,22,26)