2-[4-(azepan-1-ylsulfonyl)imidazol-1-yl]-1-[4-(2,5-dimethylphenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[4-(azepan-1-ylsulfonyl)imidazol-1-yl]-1-[4-(2,5-dimethylphenyl)piperazin-1-yl]ethanone Openeye Name: 2-[4-(azepan-1-ylsulfonyl)imidazol-1-yl]-1-[4-(2,5-dimethylphenyl)piperazin-1-yl]ethanone CAS Name: 2-[4-(1-azepanylsulfonyl)-1-imidazolyl]-1-[4-(2,5-dimethylphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)imidazol-1-yl]-1-[4-(2,5-dimethylphenyl)piperazin-1-yl]ethanone Traditional Name: 2-[4-(azepan-1-ylsulfonyl)imidazol-1-yl]-1-[4-(2,5-dimethylphenyl)piperazino]ethanone Formula: C23H33N5O3S MolecularWeight: 459.60482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CN3C=C(N=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CN3C=C(N=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H33N5O3S/c1-19-7-8-20(2)21(15-19)26-11-13-27(14-12-26)23(29)17-25-16-22(24-18-25)32(30,31)28-9-5-3-4-6-10-28/h7-8,15-16,18H,3-6,9-14,17H2,1-2H3