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

Systemtic Name: (2R)-2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(1H-indol-3-yl)propan-1-one Openeye Name: (2R)-2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(1H-indol-3-yl)propan-1-one CAS Name: (2R)-2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-1-(1H-indol-3-yl)-1-propanone IUPAC Name: (2R)-2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(1H-indol-3-yl)propan-1-one Traditional Name: (2R)-2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-1-(1H-indol-3-yl)propan-1-one Formula: C21H19N5OS MolecularWeight: 389.47346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)SC3=NN=C(N3C4CC4)C5=CC=NC=C5

Isomeric SMILES

C[C@H](C(=O)C1=CNC2=CC=CC=C21)SC3=NN=C(N3C4CC4)C5=CC=NC=C5

InChI

InChI=1S/C21H19N5OS/c1-13(19(27)17-12-23-18-5-3-2-4-16(17)18)28-21-25-24-20(26(21)15-6-7-15)14-8-10-22-11-9-14/h2-5,8-13,15,23H,6-7H2,1H3/t13-/m1/s1