3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[3-(4-phenylpiperazin-1-yl)propyl]propanamide

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[3-(4-phenylpiperazin-1-yl)propyl]propanamide Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[3-(4-phenylpiperazin-1-yl)propyl]propanamide CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-[3-(4-phenyl-1-piperazinyl)propyl]propanamide IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-[3-(4-phenylpiperazin-1-yl)propyl]propanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-[3-(4-phenylpiperazino)propyl]propionamide Formula: C23H33N5OS MolecularWeight: 427.60602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCCCN2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCCCN2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C23H33N5OS/c1-18-21(19(2)26-23(25-18)30-3)10-11-22(29)24-12-7-13-27-14-16-28(17-15-27)20-8-5-4-6-9-20/h4-6,8-9H,7,10-17H2,1-3H3,(H,24,29)