N-[(2R)-1-(4-nitrophenyl)-3-oxidanylidene-4-phenylsulfanyl-butan-2-yl]naphthalene-1-carboxamide

Systemtic Name: N-[(2R)-1-(4-nitrophenyl)-3-oxidanylidene-4-phenylsulfanyl-butan-2-yl]naphthalene-1-carboxamide Openeye Name: N-[(1R)-1-[(4-nitrophenyl)methyl]-2-oxo-3-phenylsulfanyl-propyl]naphthalene-1-carboxamide CAS Name: N-[(2R)-1-(4-nitrophenyl)-3-oxo-4-(phenylthio)butan-2-yl]-1-naphthalenecarboxamide IUPAC Name: N-[(2R)-1-(4-nitrophenyl)-3-oxo-4-phenylsulfanylbutan-2-yl]naphthalene-1-carboxamide Traditional Name: N-[(1R)-2-keto-1-(4-nitrobenzyl)-3-(phenylthio)propyl]-1-naphthamide Formula: C27H22N2O4S MolecularWeight: 470.53958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(=O)C(CC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)SCC(=O)[C@@H](CC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H22N2O4S/c30-26(18-34-22-9-2-1-3-10-22)25(17-19-13-15-21(16-14-19)29(32)33)28-27(31)24-12-6-8-20-7-4-5-11-23(20)24/h1-16,25H,17-18H2,(H,28,31)/t25-/m1/s1