6-butyl-5-chloranyl-3-sulfanyl-2H-1,3-benzoxazole

Systemtic Name: 6-butyl-5-chloranyl-3-sulfanyl-2H-1,3-benzoxazole Openeye Name: 6-butyl-5-chloro-3-sulfanyl-2H-1,3-benzoxazole CAS Name: 6-butyl-5-chloro-3-mercapto-2H-1,3-benzoxazole IUPAC Name: 6-butyl-5-chloro-3-sulfanyl-2H-1,3-benzoxazole Traditional Name: 6-butyl-5-chloro-3-mercapto-2H-1,3-benzoxazole Formula: C11H14ClNOS MolecularWeight: 243.75296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1Cl)N(CO2)S

Isomeric SMILES

CCCCC1=CC2=C(C=C1Cl)N(CO2)S

InChI

InChI=1S/C11H14ClNOS/c1-2-3-4-8-5-11-10(6-9(8)12)13(15)7-14-11/h5-6,15H,2-4,7H2,1H3