(2R)-2-[[4-azanyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(2,3-dihydroindol-1-yl)propan-1-one

Systemtic Name: (2R)-2-[[4-azanyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(2,3-dihydroindol-1-yl)propan-1-one Openeye Name: (2R)-2-[[4-amino-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-indolin-1-yl-propan-1-one CAS Name: (2R)-2-[[4-amino-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-1-(2,3-dihydroindol-1-yl)-1-propanone IUPAC Name: (2R)-2-[[4-amino-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(2,3-dihydroindol-1-yl)propan-1-one Traditional Name: (2R)-2-[[4-amino-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-1-indolin-1-yl-propan-1-one Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C21)SC3=NN=C(N3N)C4=CC=C(C=C4)OC

Isomeric SMILES

C[C@H](C(=O)N1CCC2=CC=CC=C21)SC3=NN=C(N3N)C4=CC=C(C=C4)OC

InChI

InChI=1S/C20H21N5O2S/c1-13(19(26)24-12-11-14-5-3-4-6-17(14)24)28-20-23-22-18(25(20)21)15-7-9-16(27-2)10-8-15/h3-10,13H,11-12,21H2,1-2H3/t13-/m1/s1