methyl (Z)-3-[5-(4-nitrophenyl)furan-2-yl]-2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)prop-2-enoate

Systemtic Name: methyl (Z)-3-[5-(4-nitrophenyl)furan-2-yl]-2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)prop-2-enoate Openeye Name: methyl (Z)-3-[5-(4-nitrophenyl)-2-furyl]-2-(4-oxo-2-thioxo-1H-pyrimidin-6-yl)prop-2-enoate CAS Name: (Z)-3-[5-(4-nitrophenyl)-2-furanyl]-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-3-[5-(4-nitrophenyl)furan-2-yl]-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)prop-2-enoate Traditional Name: (Z)-2-(4-keto-2-thioxo-1H-pyrimidin-6-yl)-3-[5-(4-nitrophenyl)-2-furyl]acrylic acid methyl ester Formula: C18H13N3O6S MolecularWeight: 399.37732

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CC=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC(=O)NC(=S)N3

Isomeric SMILES

COC(=O)/C(=C\C1=CC=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])/C3=CC(=O)NC(=S)N3

InChI

InChI=1S/C18H13N3O6S/c1-26-17(23)13(14-9-16(22)20-18(28)19-14)8-12-6-7-15(27-12)10-2-4-11(5-3-10)21(24)25/h2-9H,1H3,(H2,19,20,22,28)/b13-8-