4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-2-(3-methyl-1,2,4-oxadiazol-5-yl)quinoline-6-carbonitrile

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-2-(3-methyl-1,2,4-oxadiazol-5-yl)quinoline-6-carbonitrile Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-2-(3-methyl-1,2,4-oxadiazol-5-yl)quinoline-6-carbonitrile CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-quinolinecarbonitrile IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-2-(3-methyl-1,2,4-oxadiazol-5-yl)quinoline-6-carbonitrile Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-2-(3-methyl-1,2,4-oxadiazol-5-yl)quinoline-6-carbonitrile Formula: C21H16ClN5O2 MolecularWeight: 405.83704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)C2=NC3=C(C=C(C=C3)C#N)C(=C2)NCC4=CC(=C(C=C4)OC)Cl

Isomeric SMILES

CC1=NOC(=N1)C2=NC3=C(C=C(C=C3)C#N)C(=C2)NCC4=CC(=C(C=C4)OC)Cl

InChI

InChI=1S/C21H16ClN5O2/c1-12-25-21(29-27-12)19-9-18(15-7-13(10-23)3-5-17(15)26-19)24-11-14-4-6-20(28-2)16(22)8-14/h3-9H,11H2,1-2H3,(H,24,26)