3-(butan-2-ylsulfanylmethyl)-4-chloranyl-aniline

Systemtic Name: 3-(butan-2-ylsulfanylmethyl)-4-chloranyl-aniline Openeye Name: 4-chloro-3-(sec-butylsulfanylmethyl)aniline CAS Name: 3-[(butan-2-ylthio)methyl]-4-chloroaniline IUPAC Name: 3-(butan-2-ylsulfanylmethyl)-4-chloroaniline Traditional Name: [4-chloro-3-[(sec-butylthio)methyl]phenyl]amine Formula: C11H16ClNS MolecularWeight: 229.76944

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SCC1=C(C=CC(=C1)N)Cl

Isomeric SMILES

CCC(C)SCC1=C(C=CC(=C1)N)Cl

InChI

InChI=1S/C11H16ClNS/c1-3-8(2)14-7-9-6-10(13)4-5-11(9)12/h4-6,8H,3,7,13H2,1-2H3