3-[1-(1,2,4-triazol-1-yl)propyl]-1,2-benzothiazole

Systemtic Name: 3-[1-(1,2,4-triazol-1-yl)propyl]-1,2-benzothiazole Openeye Name: 3-[1-(1,2,4-triazol-1-yl)propyl]-1,2-benzothiazole CAS Name: 3-[1-(1,2,4-triazol-1-yl)propyl]-1,2-benzothiazole IUPAC Name: 3-[1-(1,2,4-triazol-1-yl)propyl]-1,2-benzothiazole Traditional Name: 3-[1-(1,2,4-triazol-1-yl)propyl]-1,2-benzothiazole Formula: C12H12N4S MolecularWeight: 244.31548

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NSC2=CC=CC=C21)N3C=NC=N3

Isomeric SMILES

CCC(C1=NSC2=CC=CC=C21)N3C=NC=N3

InChI

InChI=1S/C12H12N4S/c1-2-10(16-8-13-7-14-16)12-9-5-3-4-6-11(9)17-15-12/h3-8,10H,2H2,1H3