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

Systemtic Name: N-[(2S)-1-[(3,4-dimethylphenyl)amino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]-2-methoxy-benzamide Openeye Name: N-[(1S)-1-[(3,4-dimethylphenyl)carbamoyl]-3-methylsulfonyl-propyl]-2-methoxy-benzamide CAS Name: N-[(2S)-1-(3,4-dimethylanilino)-4-methylsulfonyl-1-oxobutan-2-yl]-2-methoxybenzamide IUPAC Name: N-[(2S)-1-(3,4-dimethylanilino)-4-methylsulfonyl-1-oxobutan-2-yl]-2-methoxybenzamide Traditional Name: N-[(1S)-1-[(3,4-dimethylphenyl)carbamoyl]-3-mesyl-propyl]-2-methoxy-benzamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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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=C2OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H](CCS(=O)(=O)C)NC(=O)C2=CC=CC=C2OC)C

InChI

InChI=1S/C21H26N2O5S/c1-14-9-10-16(13-15(14)2)22-21(25)18(11-12-29(4,26)27)23-20(24)17-7-5-6-8-19(17)28-3/h5-10,13,18H,11-12H2,1-4H3,(H,22,25)(H,23,24)/t18-/m0/s1