4-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-(2-ethylsulfanylphenyl)butanamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-(2-ethylsulfanylphenyl)butanamide Openeye Name: 4-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)-N-(2-ethylsulfanylphenyl)butanamide CAS Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-[2-(ethylthio)phenyl]butanamide IUPAC Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-(2-ethylsulfanylphenyl)butanamide Traditional Name: 4-(3-chloro-N-mesyl-4-methoxy-anilino)-N-[2-(ethylthio)phenyl]butyramide Formula: C20H25ClN2O4S2 MolecularWeight: 457.0065

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25ClN2O4S2/c1-4-28-19-9-6-5-8-17(19)22-20(24)10-7-13-23(29(3,25)26)15-11-12-18(27-2)16(21)14-15/h5-6,8-9,11-12,14H,4,7,10,13H2,1-3H3,(H,22,24)