1,1-bis(oxidanylidene)-2-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethyl)-1,2-benzothiazol-3-one

Systemtic Name: 1,1-bis(oxidanylidene)-2-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethyl)-1,2-benzothiazol-3-one Openeye Name: 1,1-dioxo-2-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethyl)-1,2-benzothiazol-3-one CAS Name: 1,1-dioxo-2-[2-(4-thieno[2,3-d]pyrimidinylthio)ethyl]-1,2-benzothiazol-3-one IUPAC Name: 1,1-dioxo-2-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethyl)-1,2-benzothiazol-3-one Traditional Name: 1,1-diketo-2-[2-(thieno[2,3-d]pyrimidin-4-ylthio)ethyl]-1,2-benzothiazol-3-one Formula: C15H11N3O3S3 MolecularWeight: 377.46114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)CCSC3=NC=NC4=C3C=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)CCSC3=NC=NC4=C3C=CS4

InChI

InChI=1S/C15H11N3O3S3/c19-15-10-3-1-2-4-12(10)24(20,21)18(15)6-8-23-14-11-5-7-22-13(11)16-9-17-14/h1-5,7,9H,6,8H2