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

Systemtic Name: 2-[(3-butyl-1,2,4-triazol-1-yl)sulfanyl]-1,3-benzothiazole Openeye Name: 2-[(3-butyl-1,2,4-triazol-1-yl)sulfanyl]-1,3-benzothiazole CAS Name: 2-[(3-butyl-1,2,4-triazol-1-yl)thio]-1,3-benzothiazole IUPAC Name: 2-[(3-butyl-1,2,4-triazol-1-yl)sulfanyl]-1,3-benzothiazole Traditional Name: 2-[(3-butyl-1,2,4-triazol-1-yl)thio]-1,3-benzothiazole Formula: C13H14N4S2 MolecularWeight: 290.40706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN(C=N1)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCCC1=NN(C=N1)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C13H14N4S2/c1-2-3-8-12-14-9-17(16-12)19-13-15-10-6-4-5-7-11(10)18-13/h4-7,9H,2-3,8H2,1H3