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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)CC(=O)NC3=C(C=CC(=C3)Cl)C#N

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)CC(=O)NC3=C(C=CC(=C3)Cl)C#N

InChI

InChI=1S/C21H23ClN4O/c1-16-3-2-4-17(11-16)14-25-7-9-26(10-8-25)15-21(27)24-20-12-19(22)6-5-18(20)13-23/h2-6,11-12H,7-10,14-15H2,1H3,(H,24,27)