3-chloranyl-2-imidazol-1-yl-N-(3-methylsulfanylpropyl)aniline

Systemtic Name: 3-chloranyl-2-imidazol-1-yl-N-(3-methylsulfanylpropyl)aniline Openeye Name: 3-chloro-2-imidazol-1-yl-N-(3-methylsulfanylpropyl)aniline CAS Name: 3-chloro-2-(1-imidazolyl)-N-[3-(methylthio)propyl]aniline IUPAC Name: 3-chloro-2-imidazol-1-yl-N-(3-methylsulfanylpropyl)aniline Traditional Name: (3-chloro-2-imidazol-1-yl-phenyl)-[3-(methylthio)propyl]amine Formula: C13H16ClN3S MolecularWeight: 281.80424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC1=C(C(=CC=C1)Cl)N2C=CN=C2

Isomeric SMILES

CSCCCNC1=C(C(=CC=C1)Cl)N2C=CN=C2

InChI

InChI=1S/C13H16ClN3S/c1-18-9-3-6-16-12-5-2-4-11(14)13(12)17-8-7-15-10-17/h2,4-5,7-8,10,16H,3,6,9H2,1H3