4-methyl-3-[2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]-1,3-thiazol-2-one

Systemtic Name: 4-methyl-3-[2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]-1,3-thiazol-2-one Openeye Name: 4-methyl-3-[2-oxo-2-[4-(p-tolylsulfonyl)-1,4-diazepan-1-yl]ethyl]thiazol-2-one CAS Name: 4-methyl-3-[2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-2-oxoethyl]-2-thiazolone IUPAC Name: 4-methyl-3-[2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-2-oxoethyl]-1,3-thiazol-2-one Traditional Name: 3-[2-keto-2-(4-tosyl-1,4-diazepan-1-yl)ethyl]-4-methyl-4-thiazolin-2-one Formula: C18H23N3O4S2 MolecularWeight: 409.52292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)CN3C(=CSC3=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)CN3C(=CSC3=O)C

InChI

InChI=1S/C18H23N3O4S2/c1-14-4-6-16(7-5-14)27(24,25)20-9-3-8-19(10-11-20)17(22)12-21-15(2)13-26-18(21)23/h4-7,13H,3,8-12H2,1-2H3