N-[[3-(1-adamantyl)thiophen-2-yl]methyl]-4-methoxy-aniline

Systemtic Name: N-[[3-(1-adamantyl)thiophen-2-yl]methyl]-4-methoxy-aniline Openeye Name: N-[[3-(1-adamantyl)-2-thienyl]methyl]-4-methoxy-aniline CAS Name: N-[[3-(1-adamantyl)-2-thiophenyl]methyl]-4-methoxyaniline IUPAC Name: N-[[3-(1-adamantyl)thiophen-2-yl]methyl]-4-methoxyaniline Traditional Name: [3-(1-adamantyl)-2-thienyl]methyl-(4-methoxyphenyl)amine Formula: C22H27NOS MolecularWeight: 353.52088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NCC2=C(C=CS2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=C(C=C1)NCC2=C(C=CS2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H27NOS/c1-24-19-4-2-18(3-5-19)23-14-21-20(6-7-25-21)22-11-15-8-16(12-22)10-17(9-15)13-22/h2-7,15-17,23H,8-14H2,1H3