(2R)-N-(5-tert-butyl-2-methoxy-phenyl)-2-(4-nitrophenyl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(5-tert-butyl-2-methoxy-phenyl)-2-(4-nitrophenyl)sulfanyl-propanamide Openeye Name: (2R)-N-(5-tert-butyl-2-methoxy-phenyl)-2-(4-nitrophenyl)sulfanyl-propanamide CAS Name: (2R)-N-(5-tert-butyl-2-methoxyphenyl)-2-[(4-nitrophenyl)thio]propanamide IUPAC Name: (2R)-N-(5-tert-butyl-2-methoxyphenyl)-2-(4-nitrophenyl)sulfanylpropanamide Traditional Name: (2R)-N-(5-tert-butyl-2-methoxy-phenyl)-2-[(4-nitrophenyl)thio]propionamide Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)C(C)(C)C)OC)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=CC(=C1)C(C)(C)C)OC)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H24N2O4S/c1-13(27-16-9-7-15(8-10-16)22(24)25)19(23)21-17-12-14(20(2,3)4)6-11-18(17)26-5/h6-13H,1-5H3,(H,21,23)/t13-/m1/s1