8-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline

Systemtic Name: 8-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline Openeye Name: 8-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline CAS Name: 8-[[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]methyl]quinoline IUPAC Name: 8-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline Traditional Name: 8-[[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]methyl]quinoline Formula: C17H18N4S MolecularWeight: 310.41662

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=NC(=NN2)SCC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1CCC(C1)C2=NC(=NN2)SCC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C17H18N4S/c1-2-6-13(5-1)16-19-17(21-20-16)22-11-14-8-3-7-12-9-4-10-18-15(12)14/h3-4,7-10,13H,1-2,5-6,11H2,(H,19,20,21)