3-methyl-N-(3-morpholin-4-ium-4-ylpropylcarbamothioyl)-1-benzofuran-2-carboxamide

Systemtic Name: 3-methyl-N-(3-morpholin-4-ium-4-ylpropylcarbamothioyl)-1-benzofuran-2-carboxamide Openeye Name: 3-methyl-N-(3-morpholin-4-ium-4-ylpropylcarbamothioyl)benzofuran-2-carboxamide CAS Name: 3-methyl-N-[[3-(4-morpholin-4-iumyl)propylamino]-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: 3-methyl-N-(3-morpholin-4-ium-4-ylpropylcarbamothioyl)-1-benzofuran-2-carboxamide Traditional Name: 3-methyl-N-(3-morpholin-4-ium-4-ylpropylthiocarbamoyl)coumarilamide Formula: C18H24N3O3S+ MolecularWeight: 362.46646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)NC(=S)NCCC[NH+]3CCOCC3

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)NC(=S)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C18H23N3O3S/c1-13-14-5-2-3-6-15(14)24-16(13)17(22)20-18(25)19-7-4-8-21-9-11-23-12-10-21/h2-3,5-6H,4,7-12H2,1H3,(H2,19,20,22,25)/p+1