4-[[2-[(3-chloranyl-2-methyl-phenyl)amino]pyridin-3-yl]methyl]-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[[2-[(3-chloranyl-2-methyl-phenyl)amino]pyridin-3-yl]methyl]-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[[2-(3-chloro-2-methyl-anilino)-3-pyridyl]methyl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[[2-(3-chloro-2-methylanilino)-3-pyridinyl]methyl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[[2-(3-chloro-2-methylanilino)pyridin-3-yl]methyl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[[2-(3-chloro-2-methyl-anilino)-3-pyridyl]methyl]-N-phenyl-piperazine-1-carboxamide Formula: C24H26ClN5O MolecularWeight: 435.94914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC2=C(C=CC=N2)CN3CCN(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC2=C(C=CC=N2)CN3CCN(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C24H26ClN5O/c1-18-21(25)10-5-11-22(18)28-23-19(7-6-12-26-23)17-29-13-15-30(16-14-29)24(31)27-20-8-3-2-4-9-20/h2-12H,13-17H2,1H3,(H,26,28)(H,27,31)