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

Systemtic Name: 2-[(4-pyridin-3-yl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-benzothiazole Openeye Name: 2-[[4-(3-pyridyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-1,3-benzothiazole CAS Name: 2-[[4-(3-pyridinyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]-1,3-benzothiazole IUPAC Name: 2-[(4-pyridin-3-yl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-benzothiazole Traditional Name: 2-[[4-(3-pyridyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-1,3-benzothiazole Formula: C18H11N5S3 MolecularWeight: 393.50844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SC3=NN=C(N3C4=CN=CC=C4)C5=CC=CS5

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SC3=NN=C(N3C4=CN=CC=C4)C5=CC=CS5

InChI

InChI=1S/C18H11N5S3/c1-2-7-14-13(6-1)20-18(25-14)26-17-22-21-16(15-8-4-10-24-15)23(17)12-5-3-9-19-11-12/h1-11H