N-[[(5S,7R)-3-(4-methylphenyl)-1-adamantyl]methyl]-1-thiophen-2-yl-methanimine

Systemtic Name: N-[[(5S,7R)-3-(4-methylphenyl)-1-adamantyl]methyl]-1-thiophen-2-yl-methanimine Openeye Name: N-[[(5S,7R)-3-(p-tolyl)-1-adamantyl]methyl]-1-(2-thienyl)methanimine CAS Name: N-[[(5S,7R)-3-(4-methylphenyl)-1-adamantyl]methyl]-1-thiophen-2-ylmethanimine IUPAC Name: N-[[(5S,7R)-3-(4-methylphenyl)-1-adamantyl]methyl]-1-thiophen-2-ylmethanimine Traditional Name: [(5S,7R)-3-(p-tolyl)-1-adamantyl]methyl-(2-thenylidene)amine Formula: C23H27NS MolecularWeight: 349.53218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)CN=CC5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)C23C[C@@H]4C[C@H](C2)CC(C4)(C3)CN=CC5=CC=CS5

InChI

InChI=1S/C23H27NS/c1-17-4-6-20(7-5-17)23-12-18-9-19(13-23)11-22(10-18,15-23)16-24-14-21-3-2-8-25-21/h2-8,14,18-19H,9-13,15-16H2,1H3/t18-,19+,22?,23?