2-[4-chloranyl-6-(diethylamino)pyrimidin-2-yl]sulfanyl-N-phenethyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-chloranyl-6-(diethylamino)pyrimidin-2-yl]sulfanyl-N-phenethyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-chloro-6-(diethylamino)pyrimidin-2-yl]sulfanyl-N-phenethyl-acetamide CAS Name: 2-[[4-chloro-6-(diethylamino)-2-pyrimidinyl]thio]-N-phenethyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-chloro-6-(diethylamino)pyrimidin-2-yl]sulfanyl-N-phenethylacetamide Traditional Name: N-benzyl-2-[[4-chloro-6-(diethylamino)pyrimidin-2-yl]thio]-N-phenethyl-acetamide Formula: C25H29ClN4OS MolecularWeight: 469.04196

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=NC(=N1)SCC(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3)Cl

Isomeric SMILES

CCN(CC)C1=CC(=NC(=N1)SCC(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C25H29ClN4OS/c1-3-29(4-2)23-17-22(26)27-25(28-23)32-19-24(31)30(18-21-13-9-6-10-14-21)16-15-20-11-7-5-8-12-20/h5-14,17H,3-4,15-16,18-19H2,1-2H3