2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]ethanamide

Systemtic Name: 2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]ethanamide Openeye Name: 2-(5-nitro-1,3-dioxo-isoindolin-2-yl)-N-[2-(2-thienylmethylsulfanyl)ethyl]acetamide CAS Name: 2-(5-nitro-1,3-dioxo-2-isoindolyl)-N-[2-(thiophen-2-ylmethylthio)ethyl]acetamide IUPAC Name: 2-(5-nitro-1,3-dioxoisoindol-2-yl)-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]acetamide Traditional Name: 2-(1,3-diketo-5-nitro-isoindolin-2-yl)-N-[2-(2-thenylthio)ethyl]acetamide Formula: C17H15N3O5S2 MolecularWeight: 405.4481

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CSCCNC(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)CSCCNC(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O5S2/c21-15(18-5-7-26-10-12-2-1-6-27-12)9-19-16(22)13-4-3-11(20(24)25)8-14(13)17(19)23/h1-4,6,8H,5,7,9-10H2,(H,18,21)