N-[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-3,4,5-trimethoxy-2-nitro-benzamide

Systemtic Name: N-[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-3,4,5-trimethoxy-2-nitro-benzamide Openeye Name: N-[4-(2-amino-2-oxo-ethyl)thiazol-2-yl]-3,4,5-trimethoxy-2-nitro-benzamide CAS Name: N-[4-(2-amino-2-oxoethyl)-2-thiazolyl]-3,4,5-trimethoxy-2-nitrobenzamide IUPAC Name: N-[4-(2-amino-2-oxoethyl)-1,3-thiazol-2-yl]-3,4,5-trimethoxy-2-nitrobenzamide Traditional Name: N-[4-(2-amino-2-keto-ethyl)thiazol-2-yl]-3,4,5-trimethoxy-2-nitro-benzamide Formula: C15H16N4O7S MolecularWeight: 396.37514

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)NC2=NC(=CS2)CC(=O)N)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)NC2=NC(=CS2)CC(=O)N)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C15H16N4O7S/c1-24-9-5-8(11(19(22)23)13(26-3)12(9)25-2)14(21)18-15-17-7(6-27-15)4-10(16)20/h5-6H,4H2,1-3H3,(H2,16,20)(H,17,18,21)