4-[(3-methylmorpholin-4-yl)sulfonylmethyl]benzenecarbothioamide

Systemtic Name: 4-[(3-methylmorpholin-4-yl)sulfonylmethyl]benzenecarbothioamide Openeye Name: 4-[(3-methylmorpholin-4-yl)sulfonylmethyl]benzenecarbothioamide CAS Name: 4-[(3-methyl-4-morpholinyl)sulfonylmethyl]benzenecarbothioamide IUPAC Name: 4-[(3-methylmorpholin-4-yl)sulfonylmethyl]benzenecarbothioamide Traditional Name: 4-[(3-methylmorpholino)sulfonylmethyl]thiobenzamide Formula: C13H18N2O3S2 MolecularWeight: 314.42362

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Descriptors Computed from Structure

Canonical SMILES:

CC1COCCN1S(=O)(=O)CC2=CC=C(C=C2)C(=S)N

Isomeric SMILES

CC1COCCN1S(=O)(=O)CC2=CC=C(C=C2)C(=S)N

InChI

InChI=1S/C13H18N2O3S2/c1-10-8-18-7-6-15(10)20(16,17)9-11-2-4-12(5-3-11)13(14)19/h2-5,10H,6-9H2,1H3,(H2,14,19)