5-(3-methoxypropylamino)-2,2,4-trimethyl-3-(4-phenylphenyl)sulfonyl-thiomorpholine-3-carboxylic acid

Systemtic Name: 5-(3-methoxypropylamino)-2,2,4-trimethyl-3-(4-phenylphenyl)sulfonyl-thiomorpholine-3-carboxylic acid Openeye Name: 5-(3-methoxypropylamino)-2,2,4-trimethyl-3-(4-phenylphenyl)sulfonyl-thiomorpholine-3-carboxylic acid CAS Name: 5-(3-methoxypropylamino)-2,2,4-trimethyl-3-(4-phenylphenyl)sulfonyl-3-thiomorpholinecarboxylic acid IUPAC Name: 5-(3-methoxypropylamino)-2,2,4-trimethyl-3-(4-phenylphenyl)sulfonylthiomorpholine-3-carboxylic acid Traditional Name: 5-(3-methoxypropylamino)-2,2,4-trimethyl-3-(4-phenylphenyl)sulfonyl-thiomorpholine-3-carboxylic acid Formula: C24H32N2O5S2 MolecularWeight: 492.65128

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(C(CS1)NCCCOC)C)(C(=O)O)S(=O)(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C

Isomeric SMILES

CC1(C(N(C(CS1)NCCCOC)C)(C(=O)O)S(=O)(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C24H32N2O5S2/c1-23(2)24(22(27)28,26(3)21(17-32-23)25-15-8-16-31-4)33(29,30)20-13-11-19(12-14-20)18-9-6-5-7-10-18/h5-7,9-14,21,25H,8,15-17H2,1-4H3,(H,27,28)