1-[1-[1,1-bis(oxidanylidene)thiolan-3-yl]-2,5-dimethyl-pyrrol-3-yl]-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]ethanone

Systemtic Name: 1-[1-[1,1-bis(oxidanylidene)thiolan-3-yl]-2,5-dimethyl-pyrrol-3-yl]-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]ethanone Openeye Name: 1-[1-(1,1-dioxothiolan-3-yl)-2,5-dimethyl-pyrrol-3-yl]-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]ethanone CAS Name: 1-[1-(1,1-dioxo-3-thiolanyl)-2,5-dimethyl-3-pyrrolyl]-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]ethanone IUPAC Name: 1-[1-(1,1-dioxothiolan-3-yl)-2,5-dimethylpyrrol-3-yl]-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]ethanone Traditional Name: 1-[1-(1,1-diketothiolan-3-yl)-2,5-dimethyl-pyrrol-3-yl]-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]ethanone Formula: C22H30N2O4S MolecularWeight: 418.5496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCN(C)CC(=O)C2=C(N(C(=C2)C)C3CCS(=O)(=O)C3)C

Isomeric SMILES

CC1=CC(=CC=C1)OCCN(C)CC(=O)C2=C(N(C(=C2)C)C3CCS(=O)(=O)C3)C

InChI

InChI=1S/C22H30N2O4S/c1-16-6-5-7-20(12-16)28-10-9-23(4)14-22(25)21-13-17(2)24(18(21)3)19-8-11-29(26,27)15-19/h5-7,12-13,19H,8-11,14-15H2,1-4H3