N-(5-chloranyl-2-cyano-phenyl)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(5-chloranyl-2-cyano-phenyl)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethanamide Openeye Name: N-(5-chloro-2-cyano-phenyl)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]acetamide CAS Name: N-(5-chloro-2-cyanophenyl)-2-[4-(2,3-dimethylphenyl)-1-piperazinyl]acetamide IUPAC Name: N-(5-chloro-2-cyanophenyl)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]acetamide Traditional Name: N-(5-chloro-2-cyano-phenyl)-2-[4-(2,3-dimethylphenyl)piperazino]acetamide Formula: C21H23ClN4O MolecularWeight: 382.88652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)CC(=O)NC3=C(C=CC(=C3)Cl)C#N)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)CC(=O)NC3=C(C=CC(=C3)Cl)C#N)C

InChI

InChI=1S/C21H23ClN4O/c1-15-4-3-5-20(16(15)2)26-10-8-25(9-11-26)14-21(27)24-19-12-18(22)7-6-17(19)13-23/h3-7,12H,8-11,14H2,1-2H3,(H,24,27)