4-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-(2-ethylsulfanylphenyl)butanamide

Systemtic Name: 4-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-(2-ethylsulfanylphenyl)butanamide Openeye Name: 4-(5-chloro-2-methyl-N-methylsulfonyl-anilino)-N-(2-ethylsulfanylphenyl)butanamide CAS Name: 4-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-[2-(ethylthio)phenyl]butanamide IUPAC Name: 4-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-(2-ethylsulfanylphenyl)butanamide Traditional Name: 4-(5-chloro-N-mesyl-2-methyl-anilino)-N-[2-(ethylthio)phenyl]butyramide Formula: C20H25ClN2O3S2 MolecularWeight: 441.0071

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1NC(=O)CCCN(C2=C(C=CC(=C2)Cl)C)S(=O)(=O)C

Isomeric SMILES

CCSC1=CC=CC=C1NC(=O)CCCN(C2=C(C=CC(=C2)Cl)C)S(=O)(=O)C

InChI

InChI=1S/C20H25ClN2O3S2/c1-4-27-19-9-6-5-8-17(19)22-20(24)10-7-13-23(28(3,25)26)18-14-16(21)12-11-15(18)2/h5-6,8-9,11-12,14H,4,7,10,13H2,1-3H3,(H,22,24)