1-butyl-5-[[5-(4-chlorophenyl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,2,3,4-tetrazole

Systemtic Name: 1-butyl-5-[[5-(4-chlorophenyl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,2,3,4-tetrazole Openeye Name: 1-butyl-5-[[5-(4-chlorophenyl)-4-(2-furylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]tetrazole CAS Name: 1-butyl-5-[[[5-(4-chlorophenyl)-4-(2-furanylmethyl)-1,2,4-triazol-3-yl]thio]methyl]tetrazole IUPAC Name: 1-butyl-5-[[5-(4-chlorophenyl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]tetrazole Traditional Name: 1-butyl-5-[[[5-(4-chlorophenyl)-4-(2-furfuryl)-1,2,4-triazol-3-yl]thio]methyl]tetrazole Formula: C19H20ClN7OS MolecularWeight: 429.9264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCCCN1C(=NN=N1)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H20ClN7OS/c1-2-3-10-27-17(21-24-25-27)13-29-19-23-22-18(14-6-8-15(20)9-7-14)26(19)12-16-5-4-11-28-16/h4-9,11H,2-3,10,12-13H2,1H3