N-[(2S)-1-[[4-(1-adamantyl)-1,3-thiazol-2-yl]amino]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-1-[[4-(1-adamantyl)-1,3-thiazol-2-yl]amino]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-2-[[4-(1-adamantyl)thiazol-2-yl]amino]-1-methyl-2-oxo-ethyl]furan-2-carboxamide CAS Name: N-[(2S)-1-[[4-(1-adamantyl)-2-thiazolyl]amino]-1-oxopropan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-1-[[4-(1-adamantyl)-1,3-thiazol-2-yl]amino]-1-oxopropan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-2-[[4-(1-adamantyl)thiazol-2-yl]amino]-2-keto-1-methyl-ethyl]-2-furamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC(=CS1)C23CC4CC(C2)CC(C4)C3)NC(=O)C5=CC=CO5

Isomeric SMILES

C[C@@H](C(=O)NC1=NC(=CS1)C23CC4CC(C2)CC(C4)C3)NC(=O)C5=CC=CO5

InChI

InChI=1S/C21H25N3O3S/c1-12(22-19(26)16-3-2-4-27-16)18(25)24-20-23-17(11-28-20)21-8-13-5-14(9-21)7-15(6-13)10-21/h2-4,11-15H,5-10H2,1H3,(H,22,26)(H,23,24,25)/t12-,13?,14?,15?,21?/m0/s1