N-[4-[1-[(5-chloranylpyridin-2-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]-4-nitro-benzamide

Systemtic Name: N-[4-[1-[(5-chloranylpyridin-2-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]-4-nitro-benzamide Openeye Name: N-[4-[2-[(5-chloro-2-pyridyl)amino]-1-methyl-2-oxo-ethyl]sulfanylphenyl]-4-nitro-benzamide CAS Name: N-[4-[[1-[(5-chloro-2-pyridinyl)amino]-1-oxopropan-2-yl]thio]phenyl]-4-nitrobenzamide IUPAC Name: N-[4-[1-[(5-chloropyridin-2-yl)amino]-1-oxopropan-2-yl]sulfanylphenyl]-4-nitrobenzamide Traditional Name: N-[4-[[2-[(5-chloro-2-pyridyl)amino]-2-keto-1-methyl-ethyl]thio]phenyl]-4-nitro-benzamide Formula: C21H17ClN4O4S MolecularWeight: 456.90208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC=C(C=C1)Cl)SC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=NC=C(C=C1)Cl)SC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H17ClN4O4S/c1-13(20(27)25-19-11-4-15(22)12-23-19)31-18-9-5-16(6-10-18)24-21(28)14-2-7-17(8-3-14)26(29)30/h2-13H,1H3,(H,24,28)(H,23,25,27)