2-[[4-(oxolan-2-ylmethyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethyl)ethanamide

Systemtic Name: 2-[[4-(oxolan-2-ylmethyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethyl)ethanamide Openeye Name: N-(1-phenylethyl)-2-[[5-(1-piperidyl)-4-(tetrahydrofuran-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[4-(2-oxolanylmethyl)-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]-N-(1-phenylethyl)acetamide IUPAC Name: 2-[[4-(oxolan-2-ylmethyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethyl)acetamide Traditional Name: N-(1-phenylethyl)-2-[[5-piperidino-4-(tetrahydrofurfuryl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C22H31N5O2S MolecularWeight: 429.57884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CSC2=NN=C(N2CC3CCCO3)N4CCCCC4

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)CSC2=NN=C(N2CC3CCCO3)N4CCCCC4

InChI

InChI=1S/C22H31N5O2S/c1-17(18-9-4-2-5-10-18)23-20(28)16-30-22-25-24-21(26-12-6-3-7-13-26)27(22)15-19-11-8-14-29-19/h2,4-5,9-10,17,19H,3,6-8,11-16H2,1H3,(H,23,28)