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

Systemtic Name: (E)-N-[6-azanyl-1-methyl-2,4-bis(oxidanylidene)-3-prop-2-ynyl-pyrimidin-5-yl]-3-(3-bromophenyl)prop-2-enamide Openeye Name: (E)-N-(6-amino-1-methyl-2,4-dioxo-3-prop-2-ynyl-pyrimidin-5-yl)-3-(3-bromophenyl)prop-2-enamide CAS Name: (E)-N-(6-amino-1-methyl-2,4-dioxo-3-prop-2-ynyl-5-pyrimidinyl)-3-(3-bromophenyl)-2-propenamide IUPAC Name: (E)-N-(6-amino-1-methyl-2,4-dioxo-3-prop-2-ynylpyrimidin-5-yl)-3-(3-bromophenyl)prop-2-enamide Traditional Name: (E)-N-(6-amino-2,4-diketo-1-methyl-3-propargyl-pyrimidin-5-yl)-3-(3-bromophenyl)acrylamide Formula: C17H15BrN4O3 MolecularWeight: 403.23

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)CC#C)NC(=O)C=CC2=CC(=CC=C2)Br)N

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)CC#C)NC(=O)/C=C/C2=CC(=CC=C2)Br)N

InChI

InChI=1S/C17H15BrN4O3/c1-3-9-22-16(24)14(15(19)21(2)17(22)25)20-13(23)8-7-11-5-4-6-12(18)10-11/h1,4-8,10H,9,19H2,2H3,(H,20,23)/b8-7+