3-[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-2H-1,2,4-triazin-5-one

Systemtic Name: 3-[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-2H-1,2,4-triazin-5-one Openeye Name: 3-[2-(1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-6-methyl-2H-1,2,4-triazin-5-one CAS Name: 3-[[2-(1H-indol-3-yl)-2-oxoethyl]thio]-6-methyl-2H-1,2,4-triazin-5-one IUPAC Name: 3-[2-(1H-indol-3-yl)-2-oxoethyl]sulfanyl-6-methyl-2H-1,2,4-triazin-5-one Traditional Name: 3-[[2-(1H-indol-3-yl)-2-keto-ethyl]thio]-6-methyl-2H-1,2,4-triazin-5-one Formula: C14H12N4O2S MolecularWeight: 300.33568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=NC1=O)SCC(=O)C2=CNC3=CC=CC=C32

Isomeric SMILES

CC1=NNC(=NC1=O)SCC(=O)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C14H12N4O2S/c1-8-13(20)16-14(18-17-8)21-7-12(19)10-6-15-11-5-3-2-4-9(10)11/h2-6,15H,7H2,1H3,(H,16,18,20)