2-methyl-N-[2-[(3-methylphenyl)methylsulfanyl]ethyl]-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: 2-methyl-N-[2-[(3-methylphenyl)methylsulfanyl]ethyl]-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: 2-methyl-5-morpholinosulfonyl-N-[2-(m-tolylmethylsulfanyl)ethyl]benzamide CAS Name: 2-methyl-N-[2-[(3-methylphenyl)methylthio]ethyl]-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: 2-methyl-N-[2-[(3-methylphenyl)methylsulfanyl]ethyl]-5-morpholin-4-ylsulfonylbenzamide Traditional Name: 2-methyl-N-[2-[(3-methylbenzyl)thio]ethyl]-5-morpholinosulfonyl-benzamide Formula: C22H28N2O4S2 MolecularWeight: 448.59872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSCCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CC1=CC(=CC=C1)CSCCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C22H28N2O4S2/c1-17-4-3-5-19(14-17)16-29-13-8-23-22(25)21-15-20(7-6-18(21)2)30(26,27)24-9-11-28-12-10-24/h3-7,14-15H,8-13,16H2,1-2H3,(H,23,25)