4-[(2-aminophenyl)amino]-1-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-2-oxidanylidene-pyrimidine-5-carbonitrile

Systemtic Name: 4-[(2-aminophenyl)amino]-1-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-2-oxidanylidene-pyrimidine-5-carbonitrile Openeye Name: 4-(2-aminoanilino)-1-[(3-chloro-4-fluoro-phenyl)methyl]-2-oxo-pyrimidine-5-carbonitrile CAS Name: 4-(2-aminoanilino)-1-[(3-chloro-4-fluorophenyl)methyl]-2-oxo-5-pyrimidinecarbonitrile IUPAC Name: 4-(2-aminoanilino)-1-[(3-chloro-4-fluorophenyl)methyl]-2-oxopyrimidine-5-carbonitrile Traditional Name: 4-(2-aminoanilino)-1-(3-chloro-4-fluoro-benzyl)-2-keto-pyrimidine-5-carbonitrile Formula: C18H13ClFN5O MolecularWeight: 369.780123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)NC2=NC(=O)N(C=C2C#N)CC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1=CC=C(C(=C1)N)NC2=NC(=O)N(C=C2C#N)CC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C18H13ClFN5O/c19-13-7-11(5-6-14(13)20)9-25-10-12(8-21)17(24-18(25)26)23-16-4-2-1-3-15(16)22/h1-7,10H,9,22H2,(H,23,24,26)