1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-(4-morpholin-4-ylsulfonylphenoxy)ethanone

Systemtic Name: 1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-(4-morpholin-4-ylsulfonylphenoxy)ethanone Openeye Name: 1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-(4-morpholinosulfonylphenoxy)ethanone CAS Name: 1-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-2-[4-(4-morpholinylsulfonyl)phenoxy]ethanone IUPAC Name: 1-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-2-(4-morpholin-4-ylsulfonylphenoxy)ethanone Traditional Name: 1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-(4-morpholinosulfonylphenoxy)ethanone Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C(=O)COC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)C(=O)COC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H26N2O5S/c1-15-13-20(16(2)23(15)17-3-4-17)21(24)14-28-18-5-7-19(8-6-18)29(25,26)22-9-11-27-12-10-22/h5-8,13,17H,3-4,9-12,14H2,1-2H3