N-[(5-methylthiophen-2-yl)methyl]-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-phenethyl-ethanamide

Systemtic Name: N-[(5-methylthiophen-2-yl)methyl]-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-phenethyl-ethanamide Openeye Name: N-[(5-methyl-2-thienyl)methyl]-2-(4-nitro-1,3-dioxo-isoindolin-2-yl)-N-phenethyl-acetamide CAS Name: N-[(5-methyl-2-thiophenyl)methyl]-2-(4-nitro-1,3-dioxo-2-isoindolyl)-N-phenethylacetamide IUPAC Name: N-[(5-methylthiophen-2-yl)methyl]-2-(4-nitro-1,3-dioxoisoindol-2-yl)-N-phenethylacetamide Traditional Name: 2-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-[(5-methyl-2-thienyl)methyl]-N-phenethyl-acetamide Formula: C24H21N3O5S MolecularWeight: 463.50564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)C(=O)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)C(=O)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H21N3O5S/c1-16-10-11-18(33-16)14-25(13-12-17-6-3-2-4-7-17)21(28)15-26-23(29)19-8-5-9-20(27(31)32)22(19)24(26)30/h2-11H,12-15H2,1H3