3,7-dimethyl-1-[[5-(phenylmethylsulfanyl)-1,3,4-oxadiazol-2-yl]methyl]quinoxalin-2-one

Systemtic Name: 3,7-dimethyl-1-[[5-(phenylmethylsulfanyl)-1,3,4-oxadiazol-2-yl]methyl]quinoxalin-2-one Openeye Name: 1-[(5-benzylsulfanyl-1,3,4-oxadiazol-2-yl)methyl]-3,7-dimethyl-quinoxalin-2-one CAS Name: 3,7-dimethyl-1-[[5-(phenylmethylthio)-1,3,4-oxadiazol-2-yl]methyl]-2-quinoxalinone IUPAC Name: 1-[(5-benzylsulfanyl-1,3,4-oxadiazol-2-yl)methyl]-3,7-dimethylquinoxalin-2-one Traditional Name: 1-[[5-(benzylthio)-1,3,4-oxadiazol-2-yl]methyl]-3,7-dimethyl-quinoxalin-2-one Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C(=O)N2CC3=NN=C(O3)SCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C(=O)N2CC3=NN=C(O3)SCC4=CC=CC=C4)C

InChI

InChI=1S/C20H18N4O2S/c1-13-8-9-16-17(10-13)24(19(25)14(2)21-16)11-18-22-23-20(26-18)27-12-15-6-4-3-5-7-15/h3-10H,11-12H2,1-2H3