5-[(4-tert-butylphenyl)sulfanylmethyl]-2-chloranyl-aniline

Systemtic Name: 5-[(4-tert-butylphenyl)sulfanylmethyl]-2-chloranyl-aniline Openeye Name: 5-[(4-tert-butylphenyl)sulfanylmethyl]-2-chloro-aniline CAS Name: 5-[[(4-tert-butylphenyl)thio]methyl]-2-chloroaniline IUPAC Name: 5-[(4-tert-butylphenyl)sulfanylmethyl]-2-chloroaniline Traditional Name: [5-[[(4-tert-butylphenyl)thio]methyl]-2-chloro-phenyl]amine Formula: C17H20ClNS MolecularWeight: 305.8654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCC2=CC(=C(C=C2)Cl)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SCC2=CC(=C(C=C2)Cl)N

InChI

InChI=1S/C17H20ClNS/c1-17(2,3)13-5-7-14(8-6-13)20-11-12-4-9-15(18)16(19)10-12/h4-10H,11,19H2,1-3H3