2-[6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]sulfanyl-N-propyl-ethanamide

Systemtic Name: 2-[6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]sulfanyl-N-propyl-ethanamide Openeye Name: 2-[6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]sulfanyl-N-propyl-acetamide CAS Name: 2-[[6-(4-phenyl-1-piperazinyl)-4-pyrimidinyl]thio]-N-propylacetamide IUPAC Name: 2-[6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]sulfanyl-N-propylacetamide Traditional Name: 2-[[6-(4-phenylpiperazino)pyrimidin-4-yl]thio]-N-propyl-acetamide Formula: C19H25N5OS MolecularWeight: 371.4997

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CSC1=NC=NC(=C1)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CCCNC(=O)CSC1=NC=NC(=C1)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C19H25N5OS/c1-2-8-20-18(25)14-26-19-13-17(21-15-22-19)24-11-9-23(10-12-24)16-6-4-3-5-7-16/h3-7,13,15H,2,8-12,14H2,1H3,(H,20,25)