N-[4-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-4-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[4-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-4-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[3-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-1-methyl-3-oxo-propyl]benzamide CAS Name: N-[4-[4-(1-azepanylsulfonyl)-1-piperazinyl]-4-oxobutan-2-yl]benzamide IUPAC Name: N-[4-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-4-oxobutan-2-yl]benzamide Traditional Name: N-[3-[4-(azepan-1-ylsulfonyl)piperazino]-3-keto-1-methyl-propyl]benzamide Formula: C21H32N4O4S MolecularWeight: 436.56818

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCN(CC1)S(=O)(=O)N2CCCCCC2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(CC(=O)N1CCN(CC1)S(=O)(=O)N2CCCCCC2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H32N4O4S/c1-18(22-21(27)19-9-5-4-6-10-19)17-20(26)23-13-15-25(16-14-23)30(28,29)24-11-7-2-3-8-12-24/h4-6,9-10,18H,2-3,7-8,11-17H2,1H3,(H,22,27)