N-[4-[1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl]sulfanylphenyl]-3-nitro-benzamide

Systemtic Name: N-[4-[1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl]sulfanylphenyl]-3-nitro-benzamide Openeye Name: N-[4-[1-methyl-2-(2-naphthylamino)-2-oxo-ethyl]sulfanylphenyl]-3-nitro-benzamide CAS Name: N-[4-[[1-(2-naphthalenylamino)-1-oxopropan-2-yl]thio]phenyl]-3-nitrobenzamide IUPAC Name: N-[4-[1-(naphthalen-2-ylamino)-1-oxopropan-2-yl]sulfanylphenyl]-3-nitrobenzamide Traditional Name: N-[4-[[2-keto-1-methyl-2-(2-naphthylamino)ethyl]thio]phenyl]-3-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(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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