3-[(5-chloranylquinolin-8-yl)methyl]-1-ethyl-2,4-bis(oxidanylidene)pyrimidine-5-carbonitrile

Systemtic Name: 3-[(5-chloranylquinolin-8-yl)methyl]-1-ethyl-2,4-bis(oxidanylidene)pyrimidine-5-carbonitrile Openeye Name: 3-[(5-chloro-8-quinolyl)methyl]-1-ethyl-2,4-dioxo-pyrimidine-5-carbonitrile CAS Name: 3-[(5-chloro-8-quinolinyl)methyl]-1-ethyl-2,4-dioxo-5-pyrimidinecarbonitrile IUPAC Name: 3-[(5-chloroquinolin-8-yl)methyl]-1-ethyl-2,4-dioxopyrimidine-5-carbonitrile Traditional Name: 3-[(5-chloro-8-quinolyl)methyl]-1-ethyl-2,4-diketo-pyrimidine-5-carbonitrile Formula: C17H13ClN4O2 MolecularWeight: 340.76372

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)N(C1=O)CC2=C3C(=C(C=C2)Cl)C=CC=N3)C#N

Isomeric SMILES

CCN1C=C(C(=O)N(C1=O)CC2=C3C(=C(C=C2)Cl)C=CC=N3)C#N

InChI

InChI=1S/C17H13ClN4O2/c1-2-21-9-12(8-19)16(23)22(17(21)24)10-11-5-6-14(18)13-4-3-7-20-15(11)13/h3-7,9H,2,10H2,1H3