4-tert-butyl-N-[(2S)-1-[(4-methylpyridin-2-yl)amino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 4-tert-butyl-N-[(2S)-1-[(4-methylpyridin-2-yl)amino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 4-tert-butyl-N-[(1S)-1-[(4-methyl-2-pyridyl)carbamoyl]-3-methylsulfonyl-propyl]benzamide CAS Name: 4-tert-butyl-N-[(2S)-1-[(4-methyl-2-pyridinyl)amino]-4-methylsulfonyl-1-oxobutan-2-yl]benzamide IUPAC Name: 4-tert-butyl-N-[(2S)-1-[(4-methylpyridin-2-yl)amino]-4-methylsulfonyl-1-oxobutan-2-yl]benzamide Traditional Name: 4-tert-butyl-N-[(1S)-3-mesyl-1-[(4-methyl-2-pyridyl)carbamoyl]propyl]benzamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O4S/c1-15-10-12-23-19(14-15)25-21(27)18(11-13-30(5,28)29)24-20(26)16-6-8-17(9-7-16)22(2,3)4/h6-10,12,14,18H,11,13H2,1-5H3,(H,24,26)(H,23,25,27)/t18-/m0/s1