4-tert-butyl-N-[6-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]pyridin-3-yl]benzamide

Systemtic Name: 4-tert-butyl-N-[6-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]pyridin-3-yl]benzamide Openeye Name: 4-tert-butyl-N-[6-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]-3-pyridyl]benzamide CAS Name: 4-tert-butyl-N-[6-[4-[(2,4-dichlorophenyl)-oxomethyl]-1-piperazinyl]-3-pyridinyl]benzamide IUPAC Name: 4-tert-butyl-N-[6-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]pyridin-3-yl]benzamide Traditional Name: 4-tert-butyl-N-[6-[4-(2,4-dichlorobenzoyl)piperazino]-3-pyridyl]benzamide Formula: C27H28Cl2N4O2 MolecularWeight: 511.44282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CN=C(C=C2)N3CCN(CC3)C(=O)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CN=C(C=C2)N3CCN(CC3)C(=O)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C27H28Cl2N4O2/c1-27(2,3)19-6-4-18(5-7-19)25(34)31-21-9-11-24(30-17-21)32-12-14-33(15-13-32)26(35)22-10-8-20(28)16-23(22)29/h4-11,16-17H,12-15H2,1-3H3,(H,31,34)