2-methoxy-N-[(2S)-1-[[4-(methylcarbamoyl)phenyl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-methoxy-N-[(2S)-1-[[4-(methylcarbamoyl)phenyl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-methoxy-N-[(1S)-1-[[4-(methylcarbamoyl)phenyl]carbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-methoxy-N-[(2S)-1-[4-(methylcarbamoyl)anilino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-methoxy-N-[(2S)-1-[4-(methylcarbamoyl)anilino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-methoxy-N-[(1S)-1-[[4-(methylcarbamoyl)phenyl]carbamoyl]-3-(methylthio)propyl]benzamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC(=O)C(CCSC)NC(=O)C2=CC=CC=C2OC

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)NC(=O)[C@H](CCSC)NC(=O)C2=CC=CC=C2OC

InChI

InChI=1S/C21H25N3O4S/c1-22-19(25)14-8-10-15(11-9-14)23-21(27)17(12-13-29-3)24-20(26)16-6-4-5-7-18(16)28-2/h4-11,17H,12-13H2,1-3H3,(H,22,25)(H,23,27)(H,24,26)/t17-/m0/s1