2-[(4-phenyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[(4-phenyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-benzothiazole Openeye Name: 2-[[4-phenyl-5-(2-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-1,3-benzothiazole CAS Name: 2-[[4-phenyl-5-(2-pyridinyl)-1,2,4-triazol-3-yl]thio]-1,3-benzothiazole IUPAC Name: 2-[(4-phenyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-benzothiazole Traditional Name: 2-[[4-phenyl-5-(2-pyridyl)-1,2,4-triazol-3-yl]thio]-1,3-benzothiazole Formula: C20H13N5S2 MolecularWeight: 387.48072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SC3=NC4=CC=CC=C4S3)C5=CC=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SC3=NC4=CC=CC=C4S3)C5=CC=CC=N5

InChI

InChI=1S/C20H13N5S2/c1-2-8-14(9-3-1)25-18(16-11-6-7-13-21-16)23-24-19(25)27-20-22-15-10-4-5-12-17(15)26-20/h1-13H