4-[4-[[4-(3-chloranyl-4-methylsulfonyl-thiophen-2-yl)carbonylmorpholin-2-yl]methoxy]-3-methoxy-phenyl]butan-2-one

Systemtic Name: 4-[4-[[4-(3-chloranyl-4-methylsulfonyl-thiophen-2-yl)carbonylmorpholin-2-yl]methoxy]-3-methoxy-phenyl]butan-2-one Openeye Name: 4-[4-[[4-(3-chloro-4-methylsulfonyl-thiophene-2-carbonyl)morpholin-2-yl]methoxy]-3-methoxy-phenyl]butan-2-one CAS Name: 4-[4-[[4-[(3-chloro-4-methylsulfonyl-2-thiophenyl)-oxomethyl]-2-morpholinyl]methoxy]-3-methoxyphenyl]-2-butanone IUPAC Name: 4-[4-[[4-(3-chloro-4-methylsulfonylthiophene-2-carbonyl)morpholin-2-yl]methoxy]-3-methoxyphenyl]butan-2-one Traditional Name: 4-[4-[[4-(3-chloro-4-mesyl-thiophene-2-carbonyl)morpholin-2-yl]methoxy]-3-methoxy-phenyl]butan-2-one Formula: C22H26ClNO7S2 MolecularWeight: 516.02734

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC(=C(C=C1)OCC2CN(CCO2)C(=O)C3=C(C(=CS3)S(=O)(=O)C)Cl)OC

Isomeric SMILES

CC(=O)CCC1=CC(=C(C=C1)OCC2CN(CCO2)C(=O)C3=C(C(=CS3)S(=O)(=O)C)Cl)OC

InChI

InChI=1S/C22H26ClNO7S2/c1-14(25)4-5-15-6-7-17(18(10-15)29-2)31-12-16-11-24(8-9-30-16)22(26)21-20(23)19(13-32-21)33(3,27)28/h6-7,10,13,16H,4-5,8-9,11-12H2,1-3H3