2-[[4-[(1-methylimidazol-2-yl)sulfanylmethyl]phenyl]methylsulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[[4-[(1-methylimidazol-2-yl)sulfanylmethyl]phenyl]methylsulfanyl]-1,3-benzothiazole Openeye Name: 2-[[4-[(1-methylimidazol-2-yl)sulfanylmethyl]phenyl]methylsulfanyl]-1,3-benzothiazole CAS Name: 2-[[4-[[(1-methyl-2-imidazolyl)thio]methyl]phenyl]methylthio]-1,3-benzothiazole IUPAC Name: 2-[[4-[(1-methylimidazol-2-yl)sulfanylmethyl]phenyl]methylsulfanyl]-1,3-benzothiazole Traditional Name: 2-[[4-[[(1-methylimidazol-2-yl)thio]methyl]benzyl]thio]-1,3-benzothiazole Formula: C19H17N3S3 MolecularWeight: 383.55338

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CN1C=CN=C1SCC2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H17N3S3/c1-22-11-10-20-18(22)23-12-14-6-8-15(9-7-14)13-24-19-21-16-4-2-3-5-17(16)25-19/h2-11H,12-13H2,1H3