4-(methylsulfanylmethyl)-N-(3-morpholin-4-ylsulfonylphenyl)benzamide

Systemtic Name: 4-(methylsulfanylmethyl)-N-(3-morpholin-4-ylsulfonylphenyl)benzamide Openeye Name: 4-(methylsulfanylmethyl)-N-(3-morpholinosulfonylphenyl)benzamide CAS Name: 4-[(methylthio)methyl]-N-[3-(4-morpholinylsulfonyl)phenyl]benzamide IUPAC Name: 4-(methylsulfanylmethyl)-N-(3-morpholin-4-ylsulfonylphenyl)benzamide Traditional Name: 4-[(methylthio)methyl]-N-(3-morpholinosulfonylphenyl)benzamide Formula: C19H22N2O4S2 MolecularWeight: 406.51898

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CSCC1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H22N2O4S2/c1-26-14-15-5-7-16(8-6-15)19(22)20-17-3-2-4-18(13-17)27(23,24)21-9-11-25-12-10-21/h2-8,13H,9-12,14H2,1H3,(H,20,22)