N-(5-tert-butyl-2-methoxy-phenyl)thian-4-amine

Systemtic Name: N-(5-tert-butyl-2-methoxy-phenyl)thian-4-amine Openeye Name: N-(5-tert-butyl-2-methoxy-phenyl)tetrahydrothiopyran-4-amine CAS Name: N-(5-tert-butyl-2-methoxyphenyl)-4-thianamine IUPAC Name: N-(5-tert-butyl-2-methoxyphenyl)thian-4-amine Traditional Name: (5-tert-butyl-2-methoxy-phenyl)-tetrahydrothiopyran-4-yl-amine Formula: C16H25NOS MolecularWeight: 279.4408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC2CCSCC2

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC2CCSCC2

InChI

InChI=1S/C16H25NOS/c1-16(2,3)12-5-6-15(18-4)14(11-12)17-13-7-9-19-10-8-13/h5-6,11,13,17H,7-10H2,1-4H3