4-[2-[6-azanyl-1-cyclopropyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-oxidanylidene-ethoxy]-3-chloranyl-benzenecarbonitrile

Systemtic Name: 4-[2-[6-azanyl-1-cyclopropyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-oxidanylidene-ethoxy]-3-chloranyl-benzenecarbonitrile Openeye Name: 4-[2-(6-amino-1-cyclopropyl-2,4-dioxo-pyrimidin-5-yl)-2-oxo-ethoxy]-3-chloro-benzonitrile CAS Name: 4-[2-(6-amino-1-cyclopropyl-2,4-dioxo-5-pyrimidinyl)-2-oxoethoxy]-3-chlorobenzonitrile IUPAC Name: 4-[2-(6-amino-1-cyclopropyl-2,4-dioxopyrimidin-5-yl)-2-oxoethoxy]-3-chlorobenzonitrile Traditional Name: 4-[2-(6-amino-1-cyclopropyl-2,4-diketo-pyrimidin-5-yl)-2-keto-ethoxy]-3-chloro-benzonitrile Formula: C16H13ClN4O4 MolecularWeight: 360.75182

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=C(C(=O)NC2=O)C(=O)COC3=C(C=C(C=C3)C#N)Cl)N

Isomeric SMILES

C1CC1N2C(=C(C(=O)NC2=O)C(=O)COC3=C(C=C(C=C3)C#N)Cl)N

InChI

InChI=1S/C16H13ClN4O4/c17-10-5-8(6-18)1-4-12(10)25-7-11(22)13-14(19)21(9-2-3-9)16(24)20-15(13)23/h1,4-5,9H,2-3,7,19H2,(H,20,23,24)