4-methylsulfanyl-3-nitro-N-[(2R)-4-phenylbutan-2-yl]benzamide

Systemtic Name: 4-methylsulfanyl-3-nitro-N-[(2R)-4-phenylbutan-2-yl]benzamide Openeye Name: N-[(1R)-1-methyl-3-phenyl-propyl]-4-methylsulfanyl-3-nitro-benzamide CAS Name: 4-(methylthio)-3-nitro-N-[(2R)-4-phenylbutan-2-yl]benzamide IUPAC Name: 4-methylsulfanyl-3-nitro-N-[(2R)-4-phenylbutan-2-yl]benzamide Traditional Name: N-[(1R)-1-methyl-3-phenyl-propyl]-4-(methylthio)-3-nitro-benzamide Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)NC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O3S/c1-13(8-9-14-6-4-3-5-7-14)19-18(21)15-10-11-17(24-2)16(12-15)20(22)23/h3-7,10-13H,8-9H2,1-2H3,(H,19,21)/t13-/m1/s1