4-[4-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]sulfonyl-N-methyl-benzamide

Systemtic Name: 4-[4-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]sulfonyl-N-methyl-benzamide Openeye Name: N-methyl-4-[4-[2-oxo-2-(sec-butylamino)ethyl]piperazin-1-yl]sulfonyl-benzamide CAS Name: 4-[[4-[2-(butan-2-ylamino)-2-oxoethyl]-1-piperazinyl]sulfonyl]-N-methylbenzamide IUPAC Name: 4-[4-[2-(butan-2-ylamino)-2-oxoethyl]piperazin-1-yl]sulfonyl-N-methylbenzamide Traditional Name: 4-[4-[2-keto-2-(sec-butylamino)ethyl]piperazino]sulfonyl-N-methyl-benzamide Formula: C18H28N4O4S MolecularWeight: 396.50432

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC

Isomeric SMILES

CCC(C)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC

InChI

InChI=1S/C18H28N4O4S/c1-4-14(2)20-17(23)13-21-9-11-22(12-10-21)27(25,26)16-7-5-15(6-8-16)18(24)19-3/h5-8,14H,4,9-13H2,1-3H3,(H,19,24)(H,20,23)