2-but-3-ynylsulfanyl-5-chloranyl-aniline

Systemtic Name: 2-but-3-ynylsulfanyl-5-chloranyl-aniline Openeye Name: 2-but-3-ynylsulfanyl-5-chloro-aniline CAS Name: 2-(but-3-ynylthio)-5-chloroaniline IUPAC Name: 2-but-3-ynylsulfanyl-5-chloroaniline Traditional Name: [2-(but-3-ynylthio)-5-chloro-phenyl]amine Formula: C10H10ClNS MolecularWeight: 211.7111

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCCSC1=C(C=C(C=C1)Cl)N

Isomeric SMILES

C#CCCSC1=C(C=C(C=C1)Cl)N

InChI

InChI=1S/C10H10ClNS/c1-2-3-6-13-10-5-4-8(11)7-9(10)12/h1,4-5,7H,3,6,12H2