4-chloranyl-N-[(2S)-1-[(2-methylphenyl)methylamino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 4-chloranyl-N-[(2S)-1-[(2-methylphenyl)methylamino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 4-chloro-N-[(1S)-3-methylsulfonyl-1-(o-tolylmethylcarbamoyl)propyl]benzamide CAS Name: 4-chloro-N-[(2S)-1-[(2-methylphenyl)methylamino]-4-methylsulfonyl-1-oxobutan-2-yl]benzamide IUPAC Name: 4-chloro-N-[(2S)-1-[(2-methylphenyl)methylamino]-4-methylsulfonyl-1-oxobutan-2-yl]benzamide Traditional Name: 4-chloro-N-[(1S)-3-mesyl-1-[(2-methylbenzyl)carbamoyl]propyl]benzamide Formula: C20H23ClN2O4S MolecularWeight: 422.92562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)C(CCS(=O)(=O)C)NC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)[C@H](CCS(=O)(=O)C)NC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H23ClN2O4S/c1-14-5-3-4-6-16(14)13-22-20(25)18(11-12-28(2,26)27)23-19(24)15-7-9-17(21)10-8-15/h3-10,18H,11-13H2,1-2H3,(H,22,25)(H,23,24)/t18-/m0/s1