N-[4-[1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl]sulfanylphenyl]-4-nitro-benzamide

Systemtic Name: N-[4-[1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl]sulfanylphenyl]-4-nitro-benzamide Openeye Name: N-[4-[1-methyl-2-(2-naphthylamino)-2-oxo-ethyl]sulfanylphenyl]-4-nitro-benzamide CAS Name: N-[4-[[1-(2-naphthalenylamino)-1-oxopropan-2-yl]thio]phenyl]-4-nitrobenzamide IUPAC Name: N-[4-[1-(naphthalen-2-ylamino)-1-oxopropan-2-yl]sulfanylphenyl]-4-nitrobenzamide Traditional Name: N-[4-[[2-keto-1-methyl-2-(2-naphthylamino)ethyl]thio]phenyl]-4-nitro-benzamide Formula: C26H21N3O4S MolecularWeight: 471.52764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=CC=CC=C2C=C1)SC3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=CC2=CC=CC=C2C=C1)SC3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H21N3O4S/c1-17(25(30)28-22-9-6-18-4-2-3-5-20(18)16-22)34-24-14-10-21(11-15-24)27-26(31)19-7-12-23(13-8-19)29(32)33/h2-17H,1H3,(H,27,31)(H,28,30)