3-(2,2-dimethoxyethyl)-2-sulfanylidene-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one

Systemtic Name: 3-(2,2-dimethoxyethyl)-2-sulfanylidene-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one Openeye Name: 3-(2,2-dimethoxyethyl)-2-thioxo-1H-benzothiopheno[3,2-d]pyrimidin-4-one CAS Name: 3-(2,2-dimethoxyethyl)-2-sulfanylidene-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one IUPAC Name: 3-(2,2-dimethoxyethyl)-2-sulfanylidene-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one Traditional Name: 3-(2,2-dimethoxyethyl)-2-thioxo-1H-benzothiopheno[3,2-d]pyrimidin-4-one Formula: C14H14N2O3S2 MolecularWeight: 322.40256

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Descriptors Computed from Structure

Canonical SMILES:

COC(CN1C(=O)C2=C(C3=CC=CC=C3S2)NC1=S)OC

Isomeric SMILES

COC(CN1C(=O)C2=C(C3=CC=CC=C3S2)NC1=S)OC

InChI

InChI=1S/C14H14N2O3S2/c1-18-10(19-2)7-16-13(17)12-11(15-14(16)20)8-5-3-4-6-9(8)21-12/h3-6,10H,7H2,1-2H3,(H,15,20)