(4-oxidanylidene-1H-[1]benzofuro[3,2-d]pyrimidin-2-yl)methyl N,N-diethylcarbamodithioate

Systemtic Name: (4-oxidanylidene-1H-[1]benzofuro[3,2-d]pyrimidin-2-yl)methyl N,N-diethylcarbamodithioate Openeye Name: (4-oxo-1H-benzofuro[3,2-d]pyrimidin-2-yl)methyl N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid (4-oxo-1H-benzofuro[3,2-d]pyrimidin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-[1]benzofuro[3,2-d]pyrimidin-2-yl)methyl N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid (4-keto-1H-benzofuro[3,2-d]pyrimidin-2-yl)methyl ester Formula: C16H17N3O2S2 MolecularWeight: 347.45508

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC1=NC(=O)C2=C(N1)C3=CC=CC=C3O2

Isomeric SMILES

CCN(CC)C(=S)SCC1=NC(=O)C2=C(N1)C3=CC=CC=C3O2

InChI

InChI=1S/C16H17N3O2S2/c1-3-19(4-2)16(22)23-9-12-17-13-10-7-5-6-8-11(10)21-14(13)15(20)18-12/h5-8H,3-4,9H2,1-2H3,(H,17,18,20)