2-(1-adamantylmethylsulfanyl)-4-methyl-quinoline

Systemtic Name: 2-(1-adamantylmethylsulfanyl)-4-methyl-quinoline Openeye Name: 2-(1-adamantylmethylsulfanyl)-4-methyl-quinoline CAS Name: 2-(1-adamantylmethylthio)-4-methylquinoline IUPAC Name: 2-(1-adamantylmethylsulfanyl)-4-methylquinoline Traditional Name: 2-(1-adamantylmethylthio)-4-methyl-quinoline Formula: C21H25NS MolecularWeight: 323.4949

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H25NS/c1-14-6-20(22-19-5-3-2-4-18(14)19)23-13-21-10-15-7-16(11-21)9-17(8-15)12-21/h2-6,15-17H,7-13H2,1H3