2-chloranyl-3-[[4-(oxolan-2-ylmethyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline

Systemtic Name: 2-chloranyl-3-[[4-(oxolan-2-ylmethyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Openeye Name: 2-chloro-3-[[5-pyrrolidin-1-yl-4-(tetrahydrofuran-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline CAS Name: 2-chloro-3-[[[4-(2-oxolanylmethyl)-5-(1-pyrrolidinyl)-1,2,4-triazol-3-yl]thio]methyl]quinoline IUPAC Name: 2-chloro-3-[[4-(oxolan-2-ylmethyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Traditional Name: 2-chloro-3-[[[5-pyrrolidino-4-(tetrahydrofurfuryl)-1,2,4-triazol-3-yl]thio]methyl]quinoline Formula: C21H24ClN5OS MolecularWeight: 429.96616

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NN=C(N2CC3CCCO3)SCC4=CC5=CC=CC=C5N=C4Cl

Isomeric SMILES

C1CCN(C1)C2=NN=C(N2CC3CCCO3)SCC4=CC5=CC=CC=C5N=C4Cl

InChI

InChI=1S/C21H24ClN5OS/c22-19-16(12-15-6-1-2-8-18(15)23-19)14-29-21-25-24-20(26-9-3-4-10-26)27(21)13-17-7-5-11-28-17/h1-2,6,8,12,17H,3-5,7,9-11,13-14H2