2-[(4-methylphenyl)methylsulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[(4-methylphenyl)methylsulfanyl]-1,3-benzothiazole Openeye Name: 2-(p-tolylmethylsulfanyl)-1,3-benzothiazole CAS Name: 2-[(4-methylphenyl)methylthio]-1,3-benzothiazole IUPAC Name: 2-[(4-methylphenyl)methylsulfanyl]-1,3-benzothiazole Traditional Name: 2-[(4-methylbenzyl)thio]-1,3-benzothiazole Formula: C15H13NS2 MolecularWeight: 271.40042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C15H13NS2/c1-11-6-8-12(9-7-11)10-17-15-16-13-4-2-3-5-14(13)18-15/h2-9H,10H2,1H3