5-ethoxy-2-(phenylmethylsulfanyl)-1,3-benzothiazole

Systemtic Name: 5-ethoxy-2-(phenylmethylsulfanyl)-1,3-benzothiazole Openeye Name: 2-benzylsulfanyl-5-ethoxy-1,3-benzothiazole CAS Name: 5-ethoxy-2-(phenylmethylthio)-1,3-benzothiazole IUPAC Name: 2-benzylsulfanyl-5-ethoxy-1,3-benzothiazole Traditional Name: 2-(benzylthio)-5-ethoxy-1,3-benzothiazole Formula: C16H15NOS2 MolecularWeight: 301.4264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)SC(=N2)SCC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC2=C(C=C1)SC(=N2)SCC3=CC=CC=C3

InChI

InChI=1S/C16H15NOS2/c1-2-18-13-8-9-15-14(10-13)17-16(20-15)19-11-12-6-4-3-5-7-12/h3-10H,2,11H2,1H3