4-methyl-3-[(4-morpholin-4-ylsulfonylthiophen-2-yl)carbonylamino]benzoic acid

Systemtic Name: 4-methyl-3-[(4-morpholin-4-ylsulfonylthiophen-2-yl)carbonylamino]benzoic acid Openeye Name: 4-methyl-3-[(4-morpholinosulfonylthiophene-2-carbonyl)amino]benzoic acid CAS Name: 4-methyl-3-[[[4-(4-morpholinylsulfonyl)-2-thiophenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-methyl-3-[(4-morpholin-4-ylsulfonylthiophene-2-carbonyl)amino]benzoic acid Traditional Name: 4-methyl-3-[(4-morpholinosulfonylthiophene-2-carbonyl)amino]benzoic acid Formula: C17H18N2O6S2 MolecularWeight: 410.46462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC(=O)C2=CC(=CS2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC(=O)C2=CC(=CS2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C17H18N2O6S2/c1-11-2-3-12(17(21)22)8-14(11)18-16(20)15-9-13(10-26-15)27(23,24)19-4-6-25-7-5-19/h2-3,8-10H,4-7H2,1H3,(H,18,20)(H,21,22)