2-(3-azanylpyridin-4-yl)sulfanyl-N-[4-chloranyl-1,1-bis(oxidanylidene)thiolan-3-yl]ethanamide

Systemtic Name: 2-(3-azanylpyridin-4-yl)sulfanyl-N-[4-chloranyl-1,1-bis(oxidanylidene)thiolan-3-yl]ethanamide Openeye Name: 2-[(3-amino-4-pyridyl)sulfanyl]-N-(4-chloro-1,1-dioxo-thiolan-3-yl)acetamide CAS Name: 2-[(3-amino-4-pyridinyl)thio]-N-(4-chloro-1,1-dioxo-3-thiolanyl)acetamide IUPAC Name: 2-(3-aminopyridin-4-yl)sulfanyl-N-(4-chloro-1,1-dioxothiolan-3-yl)acetamide Traditional Name: 2-[(3-amino-4-pyridyl)thio]-N-(4-chloro-1,1-diketo-thiolan-3-yl)acetamide Formula: C11H14ClN3O3S2 MolecularWeight: 335.83016

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CS1(=O)=O)Cl)NC(=O)CSC2=C(C=NC=C2)N

Isomeric SMILES

C1C(C(CS1(=O)=O)Cl)NC(=O)CSC2=C(C=NC=C2)N

InChI

InChI=1S/C11H14ClN3O3S2/c12-7-5-20(17,18)6-9(7)15-11(16)4-19-10-1-2-14-3-8(10)13/h1-3,7,9H,4-6,13H2,(H,15,16)