1-butyl-3-[3-[[4-chloranyl-2-cyano-3-[(2-methylquinolin-8-yl)oxymethyl]phenyl]amino]-2-oxidanylidene-propyl]urea

Systemtic Name: 1-butyl-3-[3-[[4-chloranyl-2-cyano-3-[(2-methylquinolin-8-yl)oxymethyl]phenyl]amino]-2-oxidanylidene-propyl]urea Openeye Name: 1-butyl-3-[3-[4-chloro-2-cyano-3-[(2-methyl-8-quinolyl)oxymethyl]anilino]-2-oxo-propyl]urea CAS Name: 1-butyl-3-[3-[4-chloro-2-cyano-3-[(2-methyl-8-quinolinyl)oxymethyl]anilino]-2-oxopropyl]urea IUPAC Name: 1-butyl-3-[3-[4-chloro-2-cyano-3-[(2-methylquinolin-8-yl)oxymethyl]anilino]-2-oxopropyl]urea Traditional Name: 1-butyl-3-[3-[4-chloro-2-cyano-3-[(2-methyl-8-quinolyl)oxymethyl]anilino]-2-keto-propyl]urea Formula: C26H28ClN5O3 MolecularWeight: 493.98522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NCC(=O)CNC1=C(C(=C(C=C1)Cl)COC2=CC=CC3=C2N=C(C=C3)C)C#N

Isomeric SMILES

CCCCNC(=O)NCC(=O)CNC1=C(C(=C(C=C1)Cl)COC2=CC=CC3=C2N=C(C=C3)C)C#N

InChI

InChI=1S/C26H28ClN5O3/c1-3-4-12-29-26(34)31-15-19(33)14-30-23-11-10-22(27)21(20(23)13-28)16-35-24-7-5-6-18-9-8-17(2)32-25(18)24/h5-11,30H,3-4,12,14-16H2,1-2H3,(H2,29,31,34)