2-chloranyl-N-[(2S)-1-[(3,4-dimethylphenyl)amino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[(2S)-1-[(3,4-dimethylphenyl)amino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-chloro-N-[(1S)-1-[(3,4-dimethylphenyl)carbamoyl]-3-methylsulfonyl-propyl]benzamide CAS Name: 2-chloro-N-[(2S)-1-(3,4-dimethylanilino)-4-methylsulfonyl-1-oxobutan-2-yl]benzamide IUPAC Name: 2-chloro-N-[(2S)-1-(3,4-dimethylanilino)-4-methylsulfonyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-chloro-N-[(1S)-1-[(3,4-dimethylphenyl)carbamoyl]-3-mesyl-propyl]benzamide Formula: C20H23ClN2O4S MolecularWeight: 422.92562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(CCS(=O)(=O)C)NC(=O)C2=CC=CC=C2Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H](CCS(=O)(=O)C)NC(=O)C2=CC=CC=C2Cl)C

InChI

InChI=1S/C20H23ClN2O4S/c1-13-8-9-15(12-14(13)2)22-20(25)18(10-11-28(3,26)27)23-19(24)16-6-4-5-7-17(16)21/h4-9,12,18H,10-11H2,1-3H3,(H,22,25)(H,23,24)/t18-/m0/s1