2-[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-propan-2-yl-pentanamide

Systemtic Name: 2-[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-propan-2-yl-pentanamide Openeye Name: N-isopropyl-2-[2-(2-nitroanilino)-2-oxo-ethyl]sulfanyl-pentanamide CAS Name: 2-[[2-(2-nitroanilino)-2-oxoethyl]thio]-N-propan-2-ylpentanamide IUPAC Name: 2-[2-(2-nitroanilino)-2-oxoethyl]sulfanyl-N-propan-2-ylpentanamide Traditional Name: N-isopropyl-2-[[2-keto-2-(2-nitroanilino)ethyl]thio]valeramide Formula: C16H23N3O4S MolecularWeight: 353.43652

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC(C)C)SCC(=O)NC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CCCC(C(=O)NC(C)C)SCC(=O)NC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C16H23N3O4S/c1-4-7-14(16(21)17-11(2)3)24-10-15(20)18-12-8-5-6-9-13(12)19(22)23/h5-6,8-9,11,14H,4,7,10H2,1-3H3,(H,17,21)(H,18,20)