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

Systemtic Name: 4-chloranyl-N-[(2S)-1-[(4-methylpyridin-2-yl)amino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 4-chloro-N-[(1S)-1-[(4-methyl-2-pyridyl)carbamoyl]-3-methylsulfonyl-propyl]benzamide CAS Name: 4-chloro-N-[(2S)-1-[(4-methyl-2-pyridinyl)amino]-4-methylsulfonyl-1-oxobutan-2-yl]benzamide IUPAC Name: 4-chloro-N-[(2S)-1-[(4-methylpyridin-2-yl)amino]-4-methylsulfonyl-1-oxobutan-2-yl]benzamide Traditional Name: 4-chloro-N-[(1S)-3-mesyl-1-[(4-methyl-2-pyridyl)carbamoyl]propyl]benzamide Formula: C18H20ClN3O4S MolecularWeight: 409.8871

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClN3O4S/c1-12-7-9-20-16(11-12)22-18(24)15(8-10-27(2,25)26)21-17(23)13-3-5-14(19)6-4-13/h3-7,9,11,15H,8,10H2,1-2H3,(H,21,23)(H,20,22,24)/t15-/m0/s1