N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-5-[(4-nitropyrazol-1-yl)methyl]furan-2-carboxamide

Systemtic Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-5-[(4-nitropyrazol-1-yl)methyl]furan-2-carboxamide Openeye Name: N-[4-(1-adamantyl)thiazol-2-yl]-5-[(4-nitropyrazol-1-yl)methyl]furan-2-carboxamide CAS Name: N-[4-(1-adamantyl)-2-thiazolyl]-5-[(4-nitro-1-pyrazolyl)methyl]-2-furancarboxamide IUPAC Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-5-[(4-nitropyrazol-1-yl)methyl]furan-2-carboxamide Traditional Name: N-[4-(1-adamantyl)thiazol-2-yl]-5-[(4-nitropyrazol-1-yl)methyl]-2-furamide Formula: C22H23N5O4S MolecularWeight: 453.51412

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CSC(=N4)NC(=O)C5=CC=C(O5)CN6C=C(C=N6)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CSC(=N4)NC(=O)C5=CC=C(O5)CN6C=C(C=N6)[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O4S/c28-20(18-2-1-17(31-18)11-26-10-16(9-23-26)27(29)30)25-21-24-19(12-32-21)22-6-13-3-14(7-22)5-15(4-13)8-22/h1-2,9-10,12-15H,3-8,11H2,(H,24,25,28)