4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-[(phenylmethyl)amino]-1,7-naphthyridine-3-carbonitrile

Systemtic Name: 4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-[(phenylmethyl)amino]-1,7-naphthyridine-3-carbonitrile Openeye Name: 6-(benzylamino)-4-(3-chloro-4-fluoro-anilino)-1,7-naphthyridine-3-carbonitrile CAS Name: 4-(3-chloro-4-fluoroanilino)-6-[(phenylmethyl)amino]-1,7-naphthyridine-3-carbonitrile IUPAC Name: 6-(benzylamino)-4-(3-chloro-4-fluoroanilino)-1,7-naphthyridine-3-carbonitrile Traditional Name: 6-(benzylamino)-4-(3-chloro-4-fluoro-anilino)-1,7-naphthyridine-3-carbonitrile Formula: C22H15ClFN5 MolecularWeight: 403.839403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC=C3C(=C2)C(=C(C=N3)C#N)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC=C3C(=C2)C(=C(C=N3)C#N)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C22H15ClFN5/c23-18-8-16(6-7-19(18)24)29-22-15(10-25)12-26-20-13-28-21(9-17(20)22)27-11-14-4-2-1-3-5-14/h1-9,12-13H,11H2,(H,26,29)(H,27,28)