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

Systemtic Name: 6-butyl-5-chloranyl-3-sulfanyl-2H-1,3-benzothiazole Openeye Name: 6-butyl-5-chloro-3-sulfanyl-2H-1,3-benzothiazole CAS Name: 6-butyl-5-chloro-3-mercapto-2H-1,3-benzothiazole IUPAC Name: 6-butyl-5-chloro-3-sulfanyl-2H-1,3-benzothiazole Traditional Name: 6-butyl-5-chloro-3-mercapto-2H-1,3-benzothiazole Formula: C11H14ClNS2 MolecularWeight: 259.81856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1Cl)N(CS2)S

Isomeric SMILES

CCCCC1=CC2=C(C=C1Cl)N(CS2)S

InChI

InChI=1S/C11H14ClNS2/c1-2-3-4-8-5-11-10(6-9(8)12)13(14)7-15-11/h5-6,14H,2-4,7H2,1H3