2-[[4-ethyl-5-(1-phenylethylsulfanyl)-1,2,4-triazol-3-yl]methylsulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[[4-ethyl-5-(1-phenylethylsulfanyl)-1,2,4-triazol-3-yl]methylsulfanyl]-1,3-benzothiazole Openeye Name: 2-[[4-ethyl-5-(1-phenylethylsulfanyl)-1,2,4-triazol-3-yl]methylsulfanyl]-1,3-benzothiazole CAS Name: 2-[[4-ethyl-5-(1-phenylethylthio)-1,2,4-triazol-3-yl]methylthio]-1,3-benzothiazole IUPAC Name: 2-[[4-ethyl-5-(1-phenylethylsulfanyl)-1,2,4-triazol-3-yl]methylsulfanyl]-1,3-benzothiazole Traditional Name: 2-[[4-ethyl-5-(1-phenylethylthio)-1,2,4-triazol-3-yl]methylthio]-1,3-benzothiazole Formula: C20H20N4S3 MolecularWeight: 412.5946

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C2=CC=CC=C2)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCN1C(=NN=C1SC(C)C2=CC=CC=C2)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H20N4S3/c1-3-24-18(13-25-20-21-16-11-7-8-12-17(16)27-20)22-23-19(24)26-14(2)15-9-5-4-6-10-15/h4-12,14H,3,13H2,1-2H3