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

Systemtic Name: (2R)-1-(1H-indol-3-yl)-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Openeye Name: (2R)-1-(1H-indol-3-yl)-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propan-1-one CAS Name: (2R)-1-(1H-indol-3-yl)-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]-1-propanone IUPAC Name: (2R)-1-(1H-indol-3-yl)-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Traditional Name: (2R)-1-(1H-indol-3-yl)-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]propan-1-one Formula: C18H15N5OS MolecularWeight: 349.4096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)SC3=NNC(=N3)C4=CC=NC=C4

Isomeric SMILES

C[C@H](C(=O)C1=CNC2=CC=CC=C21)SC3=NNC(=N3)C4=CC=NC=C4

InChI

InChI=1S/C18H15N5OS/c1-11(16(24)14-10-20-15-5-3-2-4-13(14)15)25-18-21-17(22-23-18)12-6-8-19-9-7-12/h2-11,20H,1H3,(H,21,22,23)/t11-/m1/s1