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

Systemtic Name: (2R)-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(2-methyl-1H-indol-3-yl)propan-1-one Openeye Name: (2R)-2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(2-methyl-1H-indol-3-yl)propan-1-one CAS Name: (2R)-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-1-(2-methyl-1H-indol-3-yl)-1-propanone IUPAC Name: (2R)-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(2-methyl-1H-indol-3-yl)propan-1-one Traditional Name: (2R)-2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-1-(2-methyl-1H-indol-3-yl)propan-1-one Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)C2=C(NC3=CC=CC=C32)C)C4=CC=NC=C4

Isomeric SMILES

CCN1C(=NN=C1S[C@H](C)C(=O)C2=C(NC3=CC=CC=C32)C)C4=CC=NC=C4

InChI

InChI=1S/C21H21N5OS/c1-4-26-20(15-9-11-22-12-10-15)24-25-21(26)28-14(3)19(27)18-13(2)23-17-8-6-5-7-16(17)18/h5-12,14,23H,4H2,1-3H3/t14-/m1/s1