5-butoxy-2-[(5-butoxy-1,3-benzothiazol-2-yl)sulfanyl]-1,3-benzothiazole

Systemtic Name: 5-butoxy-2-[(5-butoxy-1,3-benzothiazol-2-yl)sulfanyl]-1,3-benzothiazole Openeye Name: 5-butoxy-2-[(5-butoxy-1,3-benzothiazol-2-yl)sulfanyl]-1,3-benzothiazole CAS Name: 5-butoxy-2-[(5-butoxy-1,3-benzothiazol-2-yl)thio]-1,3-benzothiazole IUPAC Name: 5-butoxy-2-[(5-butoxy-1,3-benzothiazol-2-yl)sulfanyl]-1,3-benzothiazole Traditional Name: 5-butoxy-2-[(5-butoxy-1,3-benzothiazol-2-yl)thio]-1,3-benzothiazole Formula: C22H24N2O2S3 MolecularWeight: 444.63316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)SC(=N2)SC3=NC4=C(S3)C=CC(=C4)OCCCC

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)SC(=N2)SC3=NC4=C(S3)C=CC(=C4)OCCCC

InChI

InChI=1S/C22H24N2O2S3/c1-3-5-11-25-15-7-9-19-17(13-15)23-21(27-19)29-22-24-18-14-16(26-12-6-4-2)8-10-20(18)28-22/h7-10,13-14H,3-6,11-12H2,1-2H3