N-(3-cyanothiophen-2-yl)-2-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(3-cyanothiophen-2-yl)-2-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-(3-cyano-2-thienyl)-2-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]acetamide CAS Name: N-(3-cyano-2-thiophenyl)-2-[4-[(3,4-dichlorophenyl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-(3-cyanothiophen-2-yl)-2-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]acetamide Traditional Name: N-(3-cyano-2-thienyl)-2-[4-(3,4-dichlorobenzyl)piperazino]acetamide Formula: C18H18Cl2N4OS MolecularWeight: 409.33272

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=C(C=C2)Cl)Cl)CC(=O)NC3=C(C=CS3)C#N

Isomeric SMILES

C1CN(CCN1CC2=CC(=C(C=C2)Cl)Cl)CC(=O)NC3=C(C=CS3)C#N

InChI

InChI=1S/C18H18Cl2N4OS/c19-15-2-1-13(9-16(15)20)11-23-4-6-24(7-5-23)12-17(25)22-18-14(10-21)3-8-26-18/h1-3,8-9H,4-7,11-12H2,(H,22,25)