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

Systemtic Name: 4-(1-adamantyl)-N-[4-[(4-chloranylphenoxy)methyl]-1,3-thiazol-2-yl]benzamide Openeye Name: 4-(1-adamantyl)-N-[4-[(4-chlorophenoxy)methyl]thiazol-2-yl]benzamide CAS Name: 4-(1-adamantyl)-N-[4-[(4-chlorophenoxy)methyl]-2-thiazolyl]benzamide IUPAC Name: 4-(1-adamantyl)-N-[4-[(4-chlorophenoxy)methyl]-1,3-thiazol-2-yl]benzamide Traditional Name: 4-(1-adamantyl)-N-[4-[(4-chlorophenoxy)methyl]thiazol-2-yl]benzamide Formula: C27H27ClN2O2S MolecularWeight: 479.03348

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)C(=O)NC5=NC(=CS5)COC6=CC=C(C=C6)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)C(=O)NC5=NC(=CS5)COC6=CC=C(C=C6)Cl

InChI

InChI=1S/C27H27ClN2O2S/c28-22-5-7-24(8-6-22)32-15-23-16-33-26(29-23)30-25(31)20-1-3-21(4-2-20)27-12-17-9-18(13-27)11-19(10-17)14-27/h1-8,16-19H,9-15H2,(H,29,30,31)