2-(morpholin-4-ylcarbothioylamino)-1-benzothiophene-3-carboxylic acid

Systemtic Name: 2-(morpholin-4-ylcarbothioylamino)-1-benzothiophene-3-carboxylic acid Openeye Name: 2-(morpholine-4-carbothioylamino)benzothiophene-3-carboxylic acid CAS Name: 2-[[4-morpholinyl(sulfanylidene)methyl]amino]-1-benzothiophene-3-carboxylic acid IUPAC Name: 2-(morpholine-4-carbothioylamino)-1-benzothiophene-3-carboxylic acid Traditional Name: 2-(morpholine-4-carbothioylamino)benzothiophene-3-carboxylic acid Formula: C14H14N2O3S2 MolecularWeight: 322.40256

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=S)NC2=C(C3=CC=CC=C3S2)C(=O)O

Isomeric SMILES

C1COCCN1C(=S)NC2=C(C3=CC=CC=C3S2)C(=O)O

InChI

InChI=1S/C14H14N2O3S2/c17-13(18)11-9-3-1-2-4-10(9)21-12(11)15-14(20)16-5-7-19-8-6-16/h1-4H,5-8H2,(H,15,20)(H,17,18)