2-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-1,3-benzothiazole

Systemtic Name: 2-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-1,3-benzothiazole Openeye Name: 2-[(1-cyclohexyltetrazol-5-yl)sulfanylmethyl]-1,3-benzothiazole CAS Name: 2-[[(1-cyclohexyl-5-tetrazolyl)thio]methyl]-1,3-benzothiazole IUPAC Name: 2-[(1-cyclohexyltetrazol-5-yl)sulfanylmethyl]-1,3-benzothiazole Traditional Name: 2-[[(1-cyclohexyltetrazol-5-yl)thio]methyl]-1,3-benzothiazole Formula: C15H17N5S2 MolecularWeight: 331.45898

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=N2)SCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CCC(CC1)N2C(=NN=N2)SCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C15H17N5S2/c1-2-6-11(7-3-1)20-15(17-18-19-20)21-10-14-16-12-8-4-5-9-13(12)22-14/h4-5,8-9,11H,1-3,6-7,10H2