(E)-N-[6-azanyl-2,4-bis(oxidanylidene)-3-prop-2-ynyl-1H-pyrimidin-5-yl]-3-(3-methoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-[6-azanyl-2,4-bis(oxidanylidene)-3-prop-2-ynyl-1H-pyrimidin-5-yl]-3-(3-methoxyphenyl)prop-2-enamide Openeye Name: (E)-N-(6-amino-2,4-dioxo-3-prop-2-ynyl-1H-pyrimidin-5-yl)-3-(3-methoxyphenyl)prop-2-enamide CAS Name: (E)-N-(6-amino-2,4-dioxo-3-prop-2-ynyl-1H-pyrimidin-5-yl)-3-(3-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(6-amino-2,4-dioxo-3-prop-2-ynyl-1H-pyrimidin-5-yl)-3-(3-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-(6-amino-2,4-diketo-3-propargyl-1H-pyrimidin-5-yl)-3-(3-methoxyphenyl)acrylamide Formula: C17H16N4O4 MolecularWeight: 340.33334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=CC(=O)NC2=C(NC(=O)N(C2=O)CC#C)N

Isomeric SMILES

COC1=CC=CC(=C1)/C=C/C(=O)NC2=C(NC(=O)N(C2=O)CC#C)N

InChI

InChI=1S/C17H16N4O4/c1-3-9-21-16(23)14(15(18)20-17(21)24)19-13(22)8-7-11-5-4-6-12(10-11)25-2/h1,4-8,10H,9,18H2,2H3,(H,19,22)(H,20,24)/b8-7+