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

Systemtic Name: [1-methyl-5-[2-(2-pyrrolidin-1-yl-1-thiophen-2-yl-ethyl)sulfanylethylamino]-1,2,4-triazol-3-yl]methanol Openeye Name: [1-methyl-5-[2-[2-pyrrolidin-1-yl-1-(2-thienyl)ethyl]sulfanylethylamino]-1,2,4-triazol-3-yl]methanol CAS Name: [1-methyl-5-[2-[[2-(1-pyrrolidinyl)-1-thiophen-2-ylethyl]thio]ethylamino]-1,2,4-triazol-3-yl]methanol IUPAC Name: [1-methyl-5-[2-(2-pyrrolidin-1-yl-1-thiophen-2-ylethyl)sulfanylethylamino]-1,2,4-triazol-3-yl]methanol Traditional Name: [1-methyl-5-[2-[[2-pyrrolidino-1-(2-thienyl)ethyl]thio]ethylamino]-1,2,4-triazol-3-yl]methanol Formula: C16H25N5OS2 MolecularWeight: 367.5326

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)CO)NCCSC(CN2CCCC2)C3=CC=CS3

Isomeric SMILES

CN1C(=NC(=N1)CO)NCCSC(CN2CCCC2)C3=CC=CS3

InChI

InChI=1S/C16H25N5OS2/c1-20-16(18-15(12-22)19-20)17-6-10-24-14(13-5-4-9-23-13)11-21-7-2-3-8-21/h4-5,9,14,22H,2-3,6-8,10-12H2,1H3,(H,17,18,19)