4-(1-adamantyloxy)-2-(methylsulfanylmethyl)aniline

Systemtic Name: 4-(1-adamantyloxy)-2-(methylsulfanylmethyl)aniline Openeye Name: 4-(1-adamantyloxy)-2-(methylsulfanylmethyl)aniline CAS Name: 4-(1-adamantyloxy)-2-[(methylthio)methyl]aniline IUPAC Name: 4-(1-adamantyloxy)-2-(methylsulfanylmethyl)aniline Traditional Name: [4-(1-adamantyloxy)-2-[(methylthio)methyl]phenyl]amine Formula: C18H25NOS MolecularWeight: 303.4622

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=C(C=CC(=C1)OC23CC4CC(C2)CC(C4)C3)N

Isomeric SMILES

CSCC1=C(C=CC(=C1)OC23CC4CC(C2)CC(C4)C3)N

InChI

InChI=1S/C18H25NOS/c1-21-11-15-7-16(2-3-17(15)19)20-18-8-12-4-13(9-18)6-14(5-12)10-18/h2-3,7,12-14H,4-6,8-11,19H2,1H3