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

Systemtic Name: 2-[[5-(diphenylmethyl)sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methylsulfanyl]-1,3-benzothiazole Openeye Name: 2-[(5-benzhydrylsulfanyl-4-ethyl-1,2,4-triazol-3-yl)methylsulfanyl]-1,3-benzothiazole CAS Name: 2-[[5-[(diphenylmethyl)thio]-4-ethyl-1,2,4-triazol-3-yl]methylthio]-1,3-benzothiazole IUPAC Name: 2-[(5-benzhydrylsulfanyl-4-ethyl-1,2,4-triazol-3-yl)methylsulfanyl]-1,3-benzothiazole Traditional Name: 2-[[5-(benzhydrylthio)-4-ethyl-1,2,4-triazol-3-yl]methylthio]-1,3-benzothiazole Formula: C25H22N4S3 MolecularWeight: 474.66398

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C2=CC=CC=C2)C3=CC=CC=C3)CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

CCN1C(=NN=C1SC(C2=CC=CC=C2)C3=CC=CC=C3)CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H22N4S3/c1-2-29-22(17-30-25-26-20-15-9-10-16-21(20)31-25)27-28-24(29)32-23(18-11-5-3-6-12-18)19-13-7-4-8-14-19/h3-16,23H,2,17H2,1H3