N-(4-methyl-2-nitro-phenyl)-2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanyl-ethanamide

Systemtic Name: N-(4-methyl-2-nitro-phenyl)-2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanyl-ethanamide Openeye Name: 2-[2-(isopropylamino)-2-oxo-ethyl]sulfanyl-N-(4-methyl-2-nitro-phenyl)acetamide CAS Name: N-(4-methyl-2-nitrophenyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]thio]acetamide IUPAC Name: N-(4-methyl-2-nitrophenyl)-2-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanylacetamide Traditional Name: 2-[[2-(isopropylamino)-2-keto-ethyl]thio]-N-(4-methyl-2-nitro-phenyl)acetamide Formula: C14H19N3O4S MolecularWeight: 325.38336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSCC(=O)NC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSCC(=O)NC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O4S/c1-9(2)15-13(18)7-22-8-14(19)16-11-5-4-10(3)6-12(11)17(20)21/h4-6,9H,7-8H2,1-3H3,(H,15,18)(H,16,19)