1-(azepan-1-yl)-2-[[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methylsulfonyl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methylsulfonyl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[[5-methyl-2-(o-tolyl)oxazol-4-yl]methylsulfonyl]ethanone CAS Name: 1-(1-azepanyl)-2-[[5-methyl-2-(2-methylphenyl)-4-oxazolyl]methylsulfonyl]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methylsulfonyl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[[5-methyl-2-(o-tolyl)oxazol-4-yl]methylsulfonyl]ethanone Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC(=C(O2)C)CS(=O)(=O)CC(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC=CC=C1C2=NC(=C(O2)C)CS(=O)(=O)CC(=O)N3CCCCCC3

InChI

InChI=1S/C20H26N2O4S/c1-15-9-5-6-10-17(15)20-21-18(16(2)26-20)13-27(24,25)14-19(23)22-11-7-3-4-8-12-22/h5-6,9-10H,3-4,7-8,11-14H2,1-2H3