1-[3-[4-(chloromethyl)-1,3-thiazol-2-yl]propyl]azepane-2,7-dione

Systemtic Name: 1-[3-[4-(chloromethyl)-1,3-thiazol-2-yl]propyl]azepane-2,7-dione Openeye Name: 1-[3-[4-(chloromethyl)thiazol-2-yl]propyl]azepane-2,7-dione CAS Name: 1-[3-[4-(chloromethyl)-2-thiazolyl]propyl]azepane-2,7-dione IUPAC Name: 1-[3-[4-(chloromethyl)-1,3-thiazol-2-yl]propyl]azepane-2,7-dione Traditional Name: 1-[3-[4-(chloromethyl)thiazol-2-yl]propyl]azepane-2,7-quinone Formula: C13H17ClN2O2S MolecularWeight: 300.80428

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(C(=O)C1)CCCC2=NC(=CS2)CCl

Isomeric SMILES

C1CCC(=O)N(C(=O)C1)CCCC2=NC(=CS2)CCl

InChI

InChI=1S/C13H17ClN2O2S/c14-8-10-9-19-11(15-10)4-3-7-16-12(17)5-1-2-6-13(16)18/h9H,1-8H2