1-butyl-5-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,3,4-tetrazole

Systemtic Name: 1-butyl-5-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,3,4-tetrazole Openeye Name: 1-butyl-5-[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanylmethyl]tetrazole CAS Name: 1-butyl-5-[[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]methyl]tetrazole IUPAC Name: 1-butyl-5-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]tetrazole Traditional Name: 1-butyl-5-[[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]methyl]tetrazole Formula: C13H17N7S2 MolecularWeight: 335.45098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)CSC2=NN=C(N2C)C3=CC=CS3

Isomeric SMILES

CCCCN1C(=NN=N1)CSC2=NN=C(N2C)C3=CC=CS3

InChI

InChI=1S/C13H17N7S2/c1-3-4-7-20-11(14-17-18-20)9-22-13-16-15-12(19(13)2)10-6-5-8-21-10/h5-6,8H,3-4,7,9H2,1-2H3