N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-(methylsulfanylmethyl)benzamide

Systemtic Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-(methylsulfanylmethyl)benzamide Openeye Name: N-[4-(1-adamantyl)thiazol-2-yl]-4-(methylsulfanylmethyl)benzamide CAS Name: N-[4-(1-adamantyl)-2-thiazolyl]-4-[(methylthio)methyl]benzamide IUPAC Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-(methylsulfanylmethyl)benzamide Traditional Name: N-[4-(1-adamantyl)thiazol-2-yl]-4-[(methylthio)methyl]benzamide Formula: C22H26N2OS2 MolecularWeight: 398.58464

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CSCC1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H26N2OS2/c1-26-12-14-2-4-18(5-3-14)20(25)24-21-23-19(13-27-21)22-9-15-6-16(10-22)8-17(7-15)11-22/h2-5,13,15-17H,6-12H2,1H3,(H,23,24,25)