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

Systemtic Name: 1-[[4-(phenylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]quinoxalin-2-one Openeye Name: 1-[(4-benzyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]quinoxalin-2-one CAS Name: 1-[[4-(phenylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-2-quinoxalinone IUPAC Name: 1-[(4-benzyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]quinoxalin-2-one Traditional Name: 1-[(4-benzyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]quinoxalin-2-one Formula: C18H15N5OS MolecularWeight: 349.4096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NNC2=S)CN3C4=CC=CC=C4N=CC3=O

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NNC2=S)CN3C4=CC=CC=C4N=CC3=O

InChI

InChI=1S/C18H15N5OS/c24-17-10-19-14-8-4-5-9-15(14)22(17)12-16-20-21-18(25)23(16)11-13-6-2-1-3-7-13/h1-10H,11-12H2,(H,21,25)