2-[2-[4-(chloromethyl)-1,3-thiazol-2-yl]ethyl]-4H-isoquinoline-1,3-dione

Systemtic Name: 2-[2-[4-(chloromethyl)-1,3-thiazol-2-yl]ethyl]-4H-isoquinoline-1,3-dione Openeye Name: 2-[2-[4-(chloromethyl)thiazol-2-yl]ethyl]-4H-isoquinoline-1,3-dione CAS Name: 2-[2-[4-(chloromethyl)-2-thiazolyl]ethyl]-4H-isoquinoline-1,3-dione IUPAC Name: 2-[2-[4-(chloromethyl)-1,3-thiazol-2-yl]ethyl]-4H-isoquinoline-1,3-dione Traditional Name: 2-[2-[4-(chloromethyl)thiazol-2-yl]ethyl]-4H-isoquinoline-1,3-quinone Formula: C15H13ClN2O2S MolecularWeight: 320.79392

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N(C1=O)CCC3=NC(=CS3)CCl

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N(C1=O)CCC3=NC(=CS3)CCl

InChI

InChI=1S/C15H13ClN2O2S/c16-8-11-9-21-13(17-11)5-6-18-14(19)7-10-3-1-2-4-12(10)15(18)20/h1-4,9H,5-8H2