N-tert-butyl-4-[2-[(4-nitrophenyl)methylsulfanyl]ethanoylamino]benzamide

Systemtic Name: N-tert-butyl-4-[2-[(4-nitrophenyl)methylsulfanyl]ethanoylamino]benzamide Openeye Name: N-tert-butyl-4-[[2-[(4-nitrophenyl)methylsulfanyl]acetyl]amino]benzamide CAS Name: N-tert-butyl-4-[[2-[(4-nitrophenyl)methylthio]-1-oxoethyl]amino]benzamide IUPAC Name: N-tert-butyl-4-[[2-[(4-nitrophenyl)methylsulfanyl]acetyl]amino]benzamide Traditional Name: N-tert-butyl-4-[[2-[(4-nitrobenzyl)thio]acetyl]amino]benzamide Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)CSCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)CSCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O4S/c1-20(2,3)22-19(25)15-6-8-16(9-7-15)21-18(24)13-28-12-14-4-10-17(11-5-14)23(26)27/h4-11H,12-13H2,1-3H3,(H,21,24)(H,22,25)