3-nitro-N-[2-oxidanylidene-2-[2-(thiophen-3-ylmethylsulfanyl)ethylamino]ethyl]benzamide

Systemtic Name: 3-nitro-N-[2-oxidanylidene-2-[2-(thiophen-3-ylmethylsulfanyl)ethylamino]ethyl]benzamide Openeye Name: 3-nitro-N-[2-oxo-2-[2-(3-thienylmethylsulfanyl)ethylamino]ethyl]benzamide CAS Name: 3-nitro-N-[2-oxo-2-[2-(3-thiophenylmethylthio)ethylamino]ethyl]benzamide IUPAC Name: 3-nitro-N-[2-oxo-2-[2-(thiophen-3-ylmethylsulfanyl)ethylamino]ethyl]benzamide Traditional Name: N-[2-keto-2-[2-(3-thenylthio)ethylamino]ethyl]-3-nitro-benzamide Formula: C16H17N3O4S2 MolecularWeight: 379.45388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NCC(=O)NCCSCC2=CSC=C2

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NCC(=O)NCCSCC2=CSC=C2

InChI

InChI=1S/C16H17N3O4S2/c20-15(17-5-7-25-11-12-4-6-24-10-12)9-18-16(21)13-2-1-3-14(8-13)19(22)23/h1-4,6,8,10H,5,7,9,11H2,(H,17,20)(H,18,21)