(1S,2S)-N-[6-azanyl-2,4-bis(oxidanylidene)-3-prop-2-ynyl-1H-pyrimidin-5-yl]-2-phenyl-cyclopropane-1-carboxamide

Systemtic Name: (1S,2S)-N-[6-azanyl-2,4-bis(oxidanylidene)-3-prop-2-ynyl-1H-pyrimidin-5-yl]-2-phenyl-cyclopropane-1-carboxamide Openeye Name: (1S,2S)-N-(6-amino-2,4-dioxo-3-prop-2-ynyl-1H-pyrimidin-5-yl)-2-phenyl-cyclopropanecarboxamide CAS Name: (1S,2S)-N-(6-amino-2,4-dioxo-3-prop-2-ynyl-1H-pyrimidin-5-yl)-2-phenyl-1-cyclopropanecarboxamide IUPAC Name: (1S,2S)-N-(6-amino-2,4-dioxo-3-prop-2-ynyl-1H-pyrimidin-5-yl)-2-phenylcyclopropane-1-carboxamide Traditional Name: (1S,2S)-N-(6-amino-2,4-diketo-3-propargyl-1H-pyrimidin-5-yl)-2-phenyl-cyclopropanecarboxamide Formula: C17H16N4O3 MolecularWeight: 324.33394

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C(=O)C(=C(NC1=O)N)NC(=O)C2CC2C3=CC=CC=C3

Isomeric SMILES

C#CCN1C(=O)C(=C(NC1=O)N)NC(=O)[C@H]2C[C@@H]2C3=CC=CC=C3

InChI

InChI=1S/C17H16N4O3/c1-2-8-21-16(23)13(14(18)20-17(21)24)19-15(22)12-9-11(12)10-6-4-3-5-7-10/h1,3-7,11-12H,8-9,18H2,(H,19,22)(H,20,24)/t11-,12+/m1/s1