1-[[4-(3-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]quinoxalin-2-one

Systemtic Name: 1-[[4-(3-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]quinoxalin-2-one Openeye Name: 1-[[4-(3-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-3-yl]methyl]quinoxalin-2-one CAS Name: 1-[[4-(3-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-2-quinoxalinone IUPAC Name: 1-[[4-(3-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]quinoxalin-2-one Traditional Name: 1-[[4-(3-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-3-yl]methyl]quinoxalin-2-one Formula: C18H15N5O2S MolecularWeight: 365.409

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=NNC2=S)CN3C4=CC=CC=C4N=CC3=O

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=NNC2=S)CN3C4=CC=CC=C4N=CC3=O

InChI

InChI=1S/C18H15N5O2S/c1-25-13-6-4-5-12(9-13)23-16(20-21-18(23)26)11-22-15-8-3-2-7-14(15)19-10-17(22)24/h2-10H,11H2,1H3,(H,21,26)