2-chloranyl-N-[(2S)-1-[(4-ethylsulfonylphenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[(2S)-1-[(4-ethylsulfonylphenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-chloro-N-[(1S)-1-[(4-ethylsulfonylphenyl)carbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-chloro-N-[(2S)-1-(4-ethylsulfonylanilino)-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-chloro-N-[(2S)-1-(4-ethylsulfonylanilino)-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-chloro-N-[(1S)-1-[(4-esylphenyl)carbamoyl]-3-(methylthio)propyl]benzamide Formula: C20H23ClN2O4S2 MolecularWeight: 454.99062

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)C(CCSC)NC(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)[C@H](CCSC)NC(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C20H23ClN2O4S2/c1-3-29(26,27)15-10-8-14(9-11-15)22-20(25)18(12-13-28-2)23-19(24)16-6-4-5-7-17(16)21/h4-11,18H,3,12-13H2,1-2H3,(H,22,25)(H,23,24)/t18-/m0/s1