2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-benzothiazole

Systemtic Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-benzothiazole Openeye Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-benzothiazole CAS Name: 2-[[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-1,3-benzothiazole IUPAC Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-benzothiazole Traditional Name: 2-[[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-1,3-benzothiazole Formula: C16H16N4S2 MolecularWeight: 328.45504

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3CC3)SCC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC1C2=NN=C(N2C3CC3)SCC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C16H16N4S2/c1-2-4-13-12(3-1)17-14(22-13)9-21-16-19-18-15(10-5-6-10)20(16)11-7-8-11/h1-4,10-11H,5-9H2