N-[(1S)-1-(1-adamantyl)ethyl]-5-[(4-chloranylpyrazol-1-yl)methyl]furan-2-carboxamide

Systemtic Name: N-[(1S)-1-(1-adamantyl)ethyl]-5-[(4-chloranylpyrazol-1-yl)methyl]furan-2-carboxamide Openeye Name: N-[(1S)-1-(1-adamantyl)ethyl]-5-[(4-chloropyrazol-1-yl)methyl]furan-2-carboxamide CAS Name: N-[(1S)-1-(1-adamantyl)ethyl]-5-[(4-chloro-1-pyrazolyl)methyl]-2-furancarboxamide IUPAC Name: N-[(1S)-1-(1-adamantyl)ethyl]-5-[(4-chloropyrazol-1-yl)methyl]furan-2-carboxamide Traditional Name: N-[(1S)-1-(1-adamantyl)ethyl]-5-[(4-chloropyrazol-1-yl)methyl]-2-furamide Formula: C21H26ClN3O2 MolecularWeight: 387.90304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC=C(O4)CN5C=C(C=N5)Cl

Isomeric SMILES

C[C@@H](C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC=C(O4)CN5C=C(C=N5)Cl

InChI

InChI=1S/C21H26ClN3O2/c1-13(21-7-14-4-15(8-21)6-16(5-14)9-21)24-20(26)19-3-2-18(27-19)12-25-11-17(22)10-23-25/h2-3,10-11,13-16H,4-9,12H2,1H3,(H,24,26)/t13-,14?,15?,16?,21?/m0/s1