4-[(4-tert-butylphenyl)methylsulfanyl]-3-chloranyl-aniline

Systemtic Name: 4-[(4-tert-butylphenyl)methylsulfanyl]-3-chloranyl-aniline Openeye Name: 4-[(4-tert-butylphenyl)methylsulfanyl]-3-chloro-aniline CAS Name: 4-[(4-tert-butylphenyl)methylthio]-3-chloroaniline IUPAC Name: 4-[(4-tert-butylphenyl)methylsulfanyl]-3-chloroaniline Traditional Name: [4-[(4-tert-butylbenzyl)thio]-3-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)CSC2=C(C=C(C=C2)N)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=C(C=C(C=C2)N)Cl

InChI

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