[1-methyl-5-[2-(2-piperidin-1-yl-1-thiophen-3-yl-ethyl)sulfanylethylamino]-1,2,4-triazol-3-yl]methanol

Systemtic Name: [1-methyl-5-[2-(2-piperidin-1-yl-1-thiophen-3-yl-ethyl)sulfanylethylamino]-1,2,4-triazol-3-yl]methanol Openeye Name: [1-methyl-5-[2-[2-(1-piperidyl)-1-(3-thienyl)ethyl]sulfanylethylamino]-1,2,4-triazol-3-yl]methanol CAS Name: [1-methyl-5-[2-[[2-(1-piperidinyl)-1-(3-thiophenyl)ethyl]thio]ethylamino]-1,2,4-triazol-3-yl]methanol IUPAC Name: [1-methyl-5-[2-(2-piperidin-1-yl-1-thiophen-3-ylethyl)sulfanylethylamino]-1,2,4-triazol-3-yl]methanol Traditional Name: [1-methyl-5-[2-[[2-piperidino-1-(3-thienyl)ethyl]thio]ethylamino]-1,2,4-triazol-3-yl]methanol Formula: C17H27N5OS2 MolecularWeight: 381.55918

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)CO)NCCSC(CN2CCCCC2)C3=CSC=C3

Isomeric SMILES

CN1C(=NC(=N1)CO)NCCSC(CN2CCCCC2)C3=CSC=C3

InChI

InChI=1S/C17H27N5OS2/c1-21-17(19-16(12-23)20-21)18-6-10-25-15(14-5-9-24-13-14)11-22-7-3-2-4-8-22/h5,9,13,15,23H,2-4,6-8,10-12H2,1H3,(H,18,19,20)