N-[2-[(3-methylphenyl)methylsulfanyl]ethyl]-4-(morpholin-4-ylsulfonylmethyl)benzamide

Systemtic Name: N-[2-[(3-methylphenyl)methylsulfanyl]ethyl]-4-(morpholin-4-ylsulfonylmethyl)benzamide Openeye Name: 4-(morpholinosulfonylmethyl)-N-[2-(m-tolylmethylsulfanyl)ethyl]benzamide CAS Name: N-[2-[(3-methylphenyl)methylthio]ethyl]-4-(4-morpholinylsulfonylmethyl)benzamide IUPAC Name: N-[2-[(3-methylphenyl)methylsulfanyl]ethyl]-4-(morpholin-4-ylsulfonylmethyl)benzamide Traditional Name: N-[2-[(3-methylbenzyl)thio]ethyl]-4-(morpholinosulfonylmethyl)benzamide Formula: C22H28N2O4S2 MolecularWeight: 448.59872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O4S2/c1-18-3-2-4-20(15-18)16-29-14-9-23-22(25)21-7-5-19(6-8-21)17-30(26,27)24-10-12-28-13-11-24/h2-8,15H,9-14,16-17H2,1H3,(H,23,25)