1,3-diethyl-5-[1-[(4-nitrophenyl)amino]ethenyl]-6-oxidanyl-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 1,3-diethyl-5-[1-[(4-nitrophenyl)amino]ethenyl]-6-oxidanyl-2-sulfanylidene-pyrimidin-4-one Openeye Name: 1,3-diethyl-6-hydroxy-5-[1-(4-nitroanilino)vinyl]-2-thioxo-pyrimidin-4-one CAS Name: 1,3-diethyl-6-hydroxy-5-[1-(4-nitroanilino)ethenyl]-2-sulfanylidene-4-pyrimidinone IUPAC Name: 1,3-diethyl-6-hydroxy-5-[1-(4-nitroanilino)ethenyl]-2-sulfanylidenepyrimidin-4-one Traditional Name: 1,3-diethyl-6-hydroxy-5-[1-(4-nitroanilino)vinyl]-2-thioxo-pyrimidin-4-one Formula: C16H18N4O4S MolecularWeight: 362.40352

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=O)N(C1=S)CC)C(=C)NC2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CCN1C(=C(C(=O)N(C1=S)CC)C(=C)NC2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C16H18N4O4S/c1-4-18-14(21)13(15(22)19(5-2)16(18)25)10(3)17-11-6-8-12(9-7-11)20(23)24/h6-9,17,21H,3-5H2,1-2H3