N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-3-nitro-benzamide

Systemtic Name: N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-3-nitro-benzamide Openeye Name: N-[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]-3-nitro-benzamide CAS Name: N-[2-[(2-amino-2-oxoethyl)thio]phenyl]-3-nitrobenzamide IUPAC Name: N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-3-nitrobenzamide Traditional Name: N-[2-[(2-amino-2-keto-ethyl)thio]phenyl]-3-nitro-benzamide Formula: C15H13N3O4S MolecularWeight: 331.34642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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