N-[3-(2-methylpropoxy)propyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[3-(2-methylpropoxy)propyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(3-isobutoxypropyl)-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[3-(2-methylpropoxy)propyl]-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[3-(2-methylpropoxy)propyl]-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(3-isobutoxypropyl)-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C18H27N3O5S MolecularWeight: 397.48908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCCCNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCNC(=O)C2

Isomeric SMILES

CC(C)COCCCNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCNC(=O)C2

InChI

InChI=1S/C18H27N3O5S/c1-14(2)13-26-10-4-7-20-18(23)15-5-3-6-16(11-15)27(24,25)21-9-8-19-17(22)12-21/h3,5-6,11,14H,4,7-10,12-13H2,1-2H3,(H,19,22)(H,20,23)