3-(methylsulfanylmethyl)-N-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]benzamide

Systemtic Name: 3-(methylsulfanylmethyl)-N-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]benzamide Openeye Name: 3-(methylsulfanylmethyl)-N-[(5-morpholinosulfonyl-2-thienyl)methyl]benzamide CAS Name: 3-[(methylthio)methyl]-N-[[5-(4-morpholinylsulfonyl)-2-thiophenyl]methyl]benzamide IUPAC Name: 3-(methylsulfanylmethyl)-N-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]benzamide Traditional Name: 3-[(methylthio)methyl]-N-[(5-morpholinosulfonyl-2-thienyl)methyl]benzamide Formula: C18H22N2O4S3 MolecularWeight: 426.57328

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=CC(=C1)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CSCC1=CC=CC(=C1)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H22N2O4S3/c1-25-13-14-3-2-4-15(11-14)18(21)19-12-16-5-6-17(26-16)27(22,23)20-7-9-24-10-8-20/h2-6,11H,7-10,12-13H2,1H3,(H,19,21)