2-methyl-4-[3-(4-methylphenyl)-1-adamantyl]-1,3-thiazole

Systemtic Name: 2-methyl-4-[3-(4-methylphenyl)-1-adamantyl]-1,3-thiazole Openeye Name: 2-methyl-4-[3-(p-tolyl)-1-adamantyl]thiazole CAS Name: 2-methyl-4-[3-(4-methylphenyl)-1-adamantyl]thiazole IUPAC Name: 2-methyl-4-[3-(4-methylphenyl)-1-adamantyl]-1,3-thiazole Traditional Name: 2-methyl-4-[3-(p-tolyl)-1-adamantyl]thiazole Formula: C21H25NS MolecularWeight: 323.4949

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C5=CSC(=N5)C

Isomeric SMILES

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C5=CSC(=N5)C

InChI

InChI=1S/C21H25NS/c1-14-3-5-18(6-4-14)20-8-16-7-17(9-20)11-21(10-16,13-20)19-12-23-15(2)22-19/h3-6,12,16-17H,7-11,13H2,1-2H3