1-(4-methoxyphenyl)-3-(1H-1,2,4-triazol-5-ylsulfanyl)pyrrolidine-2,5-dione

Systemtic Name: 1-(4-methoxyphenyl)-3-(1H-1,2,4-triazol-5-ylsulfanyl)pyrrolidine-2,5-dione Openeye Name: 1-(4-methoxyphenyl)-3-(1H-1,2,4-triazol-5-ylsulfanyl)pyrrolidine-2,5-dione CAS Name: 1-(4-methoxyphenyl)-3-(1H-1,2,4-triazol-5-ylthio)pyrrolidine-2,5-dione IUPAC Name: 1-(4-methoxyphenyl)-3-(1H-1,2,4-triazol-5-ylsulfanyl)pyrrolidine-2,5-dione Traditional Name: 1-(4-methoxyphenyl)-3-(1H-1,2,4-triazol-5-ylthio)pyrrolidine-2,5-quinone Formula: C13H12N4O3S MolecularWeight: 304.32438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC3=NC=NN3

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC3=NC=NN3

InChI

InChI=1S/C13H12N4O3S/c1-20-9-4-2-8(3-5-9)17-11(18)6-10(12(17)19)21-13-14-7-15-16-13/h2-5,7,10H,6H2,1H3,(H,14,15,16)