(2R)-1-(azepan-1-yl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propan-1-one

Systemtic Name: (2R)-1-(azepan-1-yl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Openeye Name: (2R)-1-(azepan-1-yl)-2-[(5-isopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]propan-1-one CAS Name: (2R)-1-(1-azepanyl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)thio]-1-propanone IUPAC Name: (2R)-1-(azepan-1-yl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Traditional Name: (2R)-1-(azepan-1-yl)-2-[(5-isopropyl-1H-1,2,4-triazol-3-yl)thio]propan-1-one Formula: C14H24N4OS MolecularWeight: 296.43156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NN1)SC(C)C(=O)N2CCCCCC2

Isomeric SMILES

C[C@H](C(=O)N1CCCCCC1)SC2=NNC(=N2)C(C)C

InChI

InChI=1S/C14H24N4OS/c1-10(2)12-15-14(17-16-12)20-11(3)13(19)18-8-6-4-5-7-9-18/h10-11H,4-9H2,1-3H3,(H,15,16,17)/t11-/m1/s1