2-[[4-(furan-2-ylmethyl)-5-(4-methylpiperidin-1-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-quinolin-5-yl-propanamide

Systemtic Name: 2-[[4-(furan-2-ylmethyl)-5-(4-methylpiperidin-1-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-quinolin-5-yl-propanamide Openeye Name: 2-[[4-(2-furylmethyl)-5-(4-methyl-1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-quinolyl)propanamide CAS Name: 2-[[4-(2-furanylmethyl)-5-(4-methyl-1-piperidinyl)-1,2,4-triazol-3-yl]thio]-N-(5-quinolinyl)propanamide IUPAC Name: 2-[[4-(furan-2-ylmethyl)-5-(4-methylpiperidin-1-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-quinolin-5-ylpropanamide Traditional Name: 2-[[4-(2-furfuryl)-5-(4-methylpiperidino)-1,2,4-triazol-3-yl]thio]-N-(5-quinolyl)propionamide Formula: C25H28N6O2S MolecularWeight: 476.59382

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NN=C(N2CC3=CC=CO3)SC(C)C(=O)NC4=CC=CC5=C4C=CC=N5

Isomeric SMILES

CC1CCN(CC1)C2=NN=C(N2CC3=CC=CO3)SC(C)C(=O)NC4=CC=CC5=C4C=CC=N5

InChI

InChI=1S/C25H28N6O2S/c1-17-10-13-30(14-11-17)24-28-29-25(31(24)16-19-6-5-15-33-19)34-18(2)23(32)27-22-9-3-8-21-20(22)7-4-12-26-21/h3-9,12,15,17-18H,10-11,13-14,16H2,1-2H3,(H,27,32)