3-[6-[(3-chloranyl-4-cyano-phenyl)amino]pyrazin-2-yl]-N-(2-dimethylaminoethyl)benzamide

Systemtic Name: 3-[6-[(3-chloranyl-4-cyano-phenyl)amino]pyrazin-2-yl]-N-(2-dimethylaminoethyl)benzamide Openeye Name: 3-[6-(3-chloro-4-cyano-anilino)pyrazin-2-yl]-N-(2-dimethylaminoethyl)benzamide CAS Name: 3-[6-(3-chloro-4-cyanoanilino)-2-pyrazinyl]-N-(2-dimethylaminoethyl)benzamide IUPAC Name: 3-[6-(3-chloro-4-cyanoanilino)pyrazin-2-yl]-N-(2-dimethylaminoethyl)benzamide Traditional Name: 3-[6-(3-chloro-4-cyano-anilino)pyrazin-2-yl]-N-(2-dimethylaminoethyl)benzamide Formula: C22H21ClN6O MolecularWeight: 420.89474

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=CC=CC(=C1)C2=CN=CC(=N2)NC3=CC(=C(C=C3)C#N)Cl

Isomeric SMILES

CN(C)CCNC(=O)C1=CC=CC(=C1)C2=CN=CC(=N2)NC3=CC(=C(C=C3)C#N)Cl

InChI

InChI=1S/C22H21ClN6O/c1-29(2)9-8-26-22(30)16-5-3-4-15(10-16)20-13-25-14-21(28-20)27-18-7-6-17(12-24)19(23)11-18/h3-7,10-11,13-14H,8-9H2,1-2H3,(H,26,30)(H,27,28)