(6-oxidanyl-4-oxidanylidene-1,2-diphenyl-pyrimidin-5-yl) N,N-diethylcarbamodithioate

Systemtic Name: (6-oxidanyl-4-oxidanylidene-1,2-diphenyl-pyrimidin-5-yl) N,N-diethylcarbamodithioate Openeye Name: (6-hydroxy-4-oxo-1,2-diphenyl-pyrimidin-5-yl) N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid (6-hydroxy-4-oxo-1,2-diphenyl-5-pyrimidinyl) ester IUPAC Name: (6-hydroxy-4-oxo-1,2-diphenylpyrimidin-5-yl) N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid (6-hydroxy-4-keto-1,2-diphenyl-pyrimidin-5-yl) ester Formula: C21H21N3O2S2 MolecularWeight: 411.54034

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SC1=C(N(C(=NC1=O)C2=CC=CC=C2)C3=CC=CC=C3)O

Isomeric SMILES

CCN(CC)C(=S)SC1=C(N(C(=NC1=O)C2=CC=CC=C2)C3=CC=CC=C3)O

InChI

InChI=1S/C21H21N3O2S2/c1-3-23(4-2)21(27)28-17-19(25)22-18(15-11-7-5-8-12-15)24(20(17)26)16-13-9-6-10-14-16/h5-14,26H,3-4H2,1-2H3