2-[(4-chloranyl-2-fluoranyl-5-propan-2-yloxy-phenyl)carbamoyl]thiomorpholine-4-carboxylic acid

Systemtic Name: 2-[(4-chloranyl-2-fluoranyl-5-propan-2-yloxy-phenyl)carbamoyl]thiomorpholine-4-carboxylic acid Openeye Name: 2-[(4-chloro-2-fluoro-5-isopropoxy-phenyl)carbamoyl]thiomorpholine-4-carboxylic acid CAS Name: 2-[(4-chloro-2-fluoro-5-propan-2-yloxyanilino)-oxomethyl]-4-thiomorpholinecarboxylic acid IUPAC Name: 2-[(4-chloro-2-fluoro-5-propan-2-yloxyphenyl)carbamoyl]thiomorpholine-4-carboxylic acid Traditional Name: 2-[(4-chloro-2-fluoro-5-isopropoxy-phenyl)carbamoyl]thiomorpholine-4-carboxylic acid Formula: C15H18ClFN2O4S MolecularWeight: 376.830823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C(=C1)NC(=O)C2CN(CCS2)C(=O)O)F)Cl

Isomeric SMILES

CC(C)OC1=C(C=C(C(=C1)NC(=O)C2CN(CCS2)C(=O)O)F)Cl

InChI

InChI=1S/C15H18ClFN2O4S/c1-8(2)23-12-6-11(10(17)5-9(12)16)18-14(20)13-7-19(15(21)22)3-4-24-13/h5-6,8,13H,3-4,7H2,1-2H3,(H,18,20)(H,21,22)