1-(2-methyl-1H-indol-3-yl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(2-methyl-1H-indol-3-yl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(2-methyl-1H-indol-3-yl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone CAS Name: 1-(2-methyl-1H-indol-3-yl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(2-methyl-1H-indol-3-yl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(2-methyl-1H-indol-3-yl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]ethanone Formula: C16H18N4OS MolecularWeight: 314.40532

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1)SCC(=O)C2=C(NC3=CC=CC=C32)C

Isomeric SMILES

CCCC1=NC(=NN1)SCC(=O)C2=C(NC3=CC=CC=C32)C

InChI

InChI=1S/C16H18N4OS/c1-3-6-14-18-16(20-19-14)22-9-13(21)15-10(2)17-12-8-5-4-7-11(12)15/h4-5,7-8,17H,3,6,9H2,1-2H3,(H,18,19,20)