(2S)-1-(2-methyl-1H-indol-3-yl)-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one

Systemtic Name: (2S)-1-(2-methyl-1H-indol-3-yl)-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Openeye Name: (2S)-2-[(4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-(2-methyl-1H-indol-3-yl)propan-1-one CAS Name: (2S)-1-(2-methyl-1H-indol-3-yl)-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)thio]-1-propanone IUPAC Name: (2S)-1-(2-methyl-1H-indol-3-yl)-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Traditional Name: (2S)-2-[(4-isopropyl-1,2,4-triazol-3-yl)thio]-1-(2-methyl-1H-indol-3-yl)propan-1-one Formula: C17H20N4OS MolecularWeight: 328.4319

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C(C)SC3=NN=CN3C(C)C

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)[C@H](C)SC3=NN=CN3C(C)C

InChI

InChI=1S/C17H20N4OS/c1-10(2)21-9-18-20-17(21)23-12(4)16(22)15-11(3)19-14-8-6-5-7-13(14)15/h5-10,12,19H,1-4H3/t12-/m0/s1