5-chloranyl-2-methylsulfanyl-N-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-methylsulfanyl-N-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-methylsulfanyl-N-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]pyrimidine-4-carboxamide CAS Name: 5-chloro-2-(methylthio)-N-[[2-[(4-phenyl-1-piperazinyl)methyl]phenyl]methyl]-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-methylsulfanyl-N-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(methylthio)-N-[2-[(4-phenylpiperazino)methyl]benzyl]pyrimidine-4-carboxamide Formula: C24H26ClN5OS MolecularWeight: 468.01414

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)NCC2=CC=CC=C2CN3CCN(CC3)C4=CC=CC=C4)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)NCC2=CC=CC=C2CN3CCN(CC3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C24H26ClN5OS/c1-32-24-27-16-21(25)22(28-24)23(31)26-15-18-7-5-6-8-19(18)17-29-11-13-30(14-12-29)20-9-3-2-4-10-20/h2-10,16H,11-15,17H2,1H3,(H,26,31)