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

Systemtic Name: 4-chloranyl-2-[(4-phenyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-benzothiazole Openeye Name: 4-chloro-2-[[4-phenyl-5-(2-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-1,3-benzothiazole CAS Name: 4-chloro-2-[[4-phenyl-5-(2-pyridinyl)-1,2,4-triazol-3-yl]thio]-1,3-benzothiazole IUPAC Name: 4-chloro-2-[(4-phenyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-benzothiazole Traditional Name: 4-chloro-2-[[4-phenyl-5-(2-pyridyl)-1,2,4-triazol-3-yl]thio]-1,3-benzothiazole Formula: C20H12ClN5S2 MolecularWeight: 421.92578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SC3=NC4=C(S3)C=CC=C4Cl)C5=CC=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SC3=NC4=C(S3)C=CC=C4Cl)C5=CC=CC=N5

InChI

InChI=1S/C20H12ClN5S2/c21-14-9-6-11-16-17(14)23-20(27-16)28-19-25-24-18(15-10-4-5-12-22-15)26(19)13-7-2-1-3-8-13/h1-12H