2-[3-[(5-chloranylthiophen-3-yl)methylsulfanyl]-6-cyclopentyl-5-oxidanylidene-1,2,4-triazin-2-yl]ethanoic acid

Systemtic Name: 2-[3-[(5-chloranylthiophen-3-yl)methylsulfanyl]-6-cyclopentyl-5-oxidanylidene-1,2,4-triazin-2-yl]ethanoic acid Openeye Name: 2-[3-[(5-chloro-3-thienyl)methylsulfanyl]-6-cyclopentyl-5-oxo-1,2,4-triazin-2-yl]acetic acid CAS Name: 2-[3-[(5-chloro-3-thiophenyl)methylthio]-6-cyclopentyl-5-oxo-1,2,4-triazin-2-yl]acetic acid IUPAC Name: 2-[3-[(5-chlorothiophen-3-yl)methylsulfanyl]-6-cyclopentyl-5-oxo-1,2,4-triazin-2-yl]acetic acid Traditional Name: 2-[3-[(5-chloro-3-thienyl)methylthio]-6-cyclopentyl-5-keto-1,2,4-triazin-2-yl]acetic acid Formula: C15H16ClN3O3S2 MolecularWeight: 385.88884

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=NN(C(=NC2=O)SCC3=CSC(=C3)Cl)CC(=O)O

Isomeric SMILES

C1CCC(C1)C2=NN(C(=NC2=O)SCC3=CSC(=C3)Cl)CC(=O)O

InChI

InChI=1S/C15H16ClN3O3S2/c16-11-5-9(7-23-11)8-24-15-17-14(22)13(10-3-1-2-4-10)18-19(15)6-12(20)21/h5,7,10H,1-4,6,8H2,(H,20,21)