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

Systemtic Name: 1-(1H-indol-3-yl)-2-[[4-(3-methoxypropyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 1-(1H-indol-3-yl)-2-[[4-(3-methoxypropyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(1H-indol-3-yl)-2-[[4-(3-methoxypropyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(1H-indol-3-yl)-2-[[4-(3-methoxypropyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Traditional Name: 1-(1H-indol-3-yl)-2-[[4-(3-methoxypropyl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C16H18N4O2S MolecularWeight: 330.40472

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C=NN=C1SCC(=O)C2=CNC3=CC=CC=C32

Isomeric SMILES

COCCCN1C=NN=C1SCC(=O)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C16H18N4O2S/c1-22-8-4-7-20-11-18-19-16(20)23-10-15(21)13-9-17-14-6-3-2-5-12(13)14/h2-3,5-6,9,11,17H,4,7-8,10H2,1H3