1-(2-methyl-1H-indol-3-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propan-1-one

Systemtic Name: 1-(2-methyl-1H-indol-3-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propan-1-one Openeye Name: 1-(2-methyl-1H-indol-3-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propan-1-one CAS Name: 1-(2-methyl-1H-indol-3-yl)-2-(1H-1,2,4-triazol-5-ylthio)-1-propanone IUPAC Name: 1-(2-methyl-1H-indol-3-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propan-1-one Traditional Name: 1-(2-methyl-1H-indol-3-yl)-2-(1H-1,2,4-triazol-5-ylthio)propan-1-one Formula: C14H14N4OS MolecularWeight: 286.35216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C(C)SC3=NC=NN3

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)C(C)SC3=NC=NN3

InChI

InChI=1S/C14H14N4OS/c1-8-12(10-5-3-4-6-11(10)17-8)13(19)9(2)20-14-15-7-16-18-14/h3-7,9,17H,1-2H3,(H,15,16,18)