N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(4-ethanoylpiperazin-1-yl)-4-oxidanylidene-butanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(4-ethanoylpiperazin-1-yl)-4-oxidanylidene-butanamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-N-[4-(azepan-1-ylsulfonyl)phenyl]-4-oxo-butanamide CAS Name: 4-(4-acetyl-1-piperazinyl)-N-[4-(1-azepanylsulfonyl)phenyl]-4-oxobutanamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-N-[4-(azepan-1-ylsulfonyl)phenyl]-4-oxobutanamide Traditional Name: 4-(4-acetylpiperazino)-N-[4-(azepan-1-ylsulfonyl)phenyl]-4-keto-butyramide Formula: C22H32N4O5S MolecularWeight: 464.57828

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)CCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)CCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H32N4O5S/c1-18(27)24-14-16-25(17-15-24)22(29)11-10-21(28)23-19-6-8-20(9-7-19)32(30,31)26-12-4-2-3-5-13-26/h6-9H,2-5,10-17H2,1H3,(H,23,28)