N-[4-(2-adamantyl)-1,3-thiazol-2-yl]-6-nitro-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-[4-(2-adamantyl)-1,3-thiazol-2-yl]-6-nitro-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[4-(2-adamantyl)thiazol-2-yl]-6-nitro-2-oxo-chromene-3-carboxamide CAS Name: N-[4-(2-adamantyl)-2-thiazolyl]-6-nitro-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[4-(2-adamantyl)-1,3-thiazol-2-yl]-6-nitro-2-oxochromene-3-carboxamide Traditional Name: N-[4-(2-adamantyl)thiazol-2-yl]-2-keto-6-nitro-chromene-3-carboxamide Formula: C23H21N3O5S MolecularWeight: 451.49494

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3C4=CSC(=N4)NC(=O)C5=CC6=C(C=CC(=C6)[N+](=O)[O-])OC5=O

Isomeric SMILES

C1C2CC3CC1CC(C2)C3C4=CSC(=N4)NC(=O)C5=CC6=C(C=CC(=C6)[N+](=O)[O-])OC5=O

InChI

InChI=1S/C23H21N3O5S/c27-21(17-9-13-8-16(26(29)30)1-2-19(13)31-22(17)28)25-23-24-18(10-32-23)20-14-4-11-3-12(6-14)7-15(20)5-11/h1-2,8-12,14-15,20H,3-7H2,(H,24,25,27)