N-(2-azanyl-2-oxidanylidene-1-phenylsulfanyl-ethyl)-4-nitro-benzamide

Systemtic Name: N-(2-azanyl-2-oxidanylidene-1-phenylsulfanyl-ethyl)-4-nitro-benzamide Openeye Name: N-(2-amino-2-oxo-1-phenylsulfanyl-ethyl)-4-nitro-benzamide CAS Name: N-[2-amino-2-oxo-1-(phenylthio)ethyl]-4-nitrobenzamide IUPAC Name: N-(2-amino-2-oxo-1-phenylsulfanylethyl)-4-nitrobenzamide Traditional Name: N-[2-amino-2-keto-1-(phenylthio)ethyl]-4-nitro-benzamide Formula: C15H13N3O4S MolecularWeight: 331.34642

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC(C(=O)N)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)SC(C(=O)N)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O4S/c16-13(19)15(23-12-4-2-1-3-5-12)17-14(20)10-6-8-11(9-7-10)18(21)22/h1-9,15H,(H2,16,19)(H,17,20)