N-(2-tert-butylsulfanylethyl)-2-[(3-chloranyl-4-methyl-phenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-(2-tert-butylsulfanylethyl)-2-[(3-chloranyl-4-methyl-phenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-(2-tert-butylsulfanylethyl)-2-(3-chloro-4-methyl-N-methylsulfonyl-anilino)acetamide CAS Name: N-[2-(tert-butylthio)ethyl]-2-(3-chloro-4-methyl-N-methylsulfonylanilino)acetamide IUPAC Name: N-(2-tert-butylsulfanylethyl)-2-(3-chloro-4-methyl-N-methylsulfonylanilino)acetamide Traditional Name: N-[2-(tert-butylthio)ethyl]-2-(3-chloro-N-mesyl-4-methyl-anilino)acetamide Formula: C16H25ClN2O3S2 MolecularWeight: 392.9643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CC(=O)NCCSC(C)(C)C)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N(CC(=O)NCCSC(C)(C)C)S(=O)(=O)C)Cl

InChI

InChI=1S/C16H25ClN2O3S2/c1-12-6-7-13(10-14(12)17)19(24(5,21)22)11-15(20)18-8-9-23-16(2,3)4/h6-7,10H,8-9,11H2,1-5H3,(H,18,20)