1-[(E)-[7-ethynyl-2-(3-methylimidazol-4-yl)quinolin-4-yl]methylideneamino]urea

Systemtic Name: 1-[(E)-[7-ethynyl-2-(3-methylimidazol-4-yl)quinolin-4-yl]methylideneamino]urea Openeye Name: [(E)-[7-ethynyl-2-(3-methylimidazol-4-yl)-4-quinolyl]methyleneamino]urea CAS Name: [(E)-[7-ethynyl-2-(3-methyl-4-imidazolyl)-4-quinolinyl]methylideneamino]urea IUPAC Name: [(E)-[7-ethynyl-2-(3-methylimidazol-4-yl)quinolin-4-yl]methylideneamino]urea Traditional Name: [(E)-[7-ethynyl-2-(3-methylimidazol-4-yl)-4-quinolyl]methyleneamino]urea Formula: C17H14N6O MolecularWeight: 318.33266

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C2=NC3=C(C=CC(=C3)C#C)C(=C2)C=NNC(=O)N

Isomeric SMILES

CN1C=NC=C1C2=NC3=C(C=CC(=C3)C#C)C(=C2)/C=N/NC(=O)N

InChI

InChI=1S/C17H14N6O/c1-3-11-4-5-13-12(8-20-22-17(18)24)7-15(21-14(13)6-11)16-9-19-10-23(16)2/h1,4-10H,2H3,(H3,18,22,24)/b20-8+