2-chloranyl-5-(5-morpholin-4-ylcarbothioylfuran-2-yl)benzoic acid

Systemtic Name: 2-chloranyl-5-(5-morpholin-4-ylcarbothioylfuran-2-yl)benzoic acid Openeye Name: 2-chloro-5-[5-(morpholine-4-carbothioyl)-2-furyl]benzoic acid CAS Name: 2-chloro-5-[5-[4-morpholinyl(sulfanylidene)methyl]-2-furanyl]benzoic acid IUPAC Name: 2-chloro-5-[5-(morpholine-4-carbothioyl)furan-2-yl]benzoic acid Traditional Name: 2-chloro-5-[5-(morpholine-4-carbothioyl)-2-furyl]benzoic acid Formula: C16H14ClNO4S MolecularWeight: 351.80466

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=S)C2=CC=C(O2)C3=CC(=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1COCCN1C(=S)C2=CC=C(O2)C3=CC(=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C16H14ClNO4S/c17-12-2-1-10(9-11(12)16(19)20)13-3-4-14(22-13)15(23)18-5-7-21-8-6-18/h1-4,9H,5-8H2,(H,19,20)