4-chloranyl-2-(1,2,4-triazol-1-yl)-1,3-benzothiazole

Systemtic Name: 4-chloranyl-2-(1,2,4-triazol-1-yl)-1,3-benzothiazole Openeye Name: 4-chloro-2-(1,2,4-triazol-1-yl)-1,3-benzothiazole CAS Name: 4-chloro-2-(1,2,4-triazol-1-yl)-1,3-benzothiazole IUPAC Name: 4-chloro-2-(1,2,4-triazol-1-yl)-1,3-benzothiazole Traditional Name: 4-chloro-2-(1,2,4-triazol-1-yl)-1,3-benzothiazole Formula: C9H5ClN4S MolecularWeight: 236.6808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Cl)N=C(S2)N3C=NC=N3

Isomeric SMILES

C1=CC2=C(C(=C1)Cl)N=C(S2)N3C=NC=N3

InChI

InChI=1S/C9H5ClN4S/c10-6-2-1-3-7-8(6)13-9(15-7)14-5-11-4-12-14/h1-5H