3-[(5-methyl-4-morpholin-4-ylsulfonyl-thiophen-2-yl)carbonylamino]benzoic acid

Systemtic Name: 3-[(5-methyl-4-morpholin-4-ylsulfonyl-thiophen-2-yl)carbonylamino]benzoic acid Openeye Name: 3-[(5-methyl-4-morpholinosulfonyl-thiophene-2-carbonyl)amino]benzoic acid CAS Name: 3-[[[5-methyl-4-(4-morpholinylsulfonyl)-2-thiophenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[(5-methyl-4-morpholin-4-ylsulfonylthiophene-2-carbonyl)amino]benzoic acid Traditional Name: 3-[(5-methyl-4-morpholinosulfonyl-thiophene-2-carbonyl)amino]benzoic acid Formula: C17H18N2O6S2 MolecularWeight: 410.46462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C(=O)NC2=CC=CC(=C2)C(=O)O)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(S1)C(=O)NC2=CC=CC(=C2)C(=O)O)S(=O)(=O)N3CCOCC3

InChI

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