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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29ClN4OS/c1-3-15-29(2)23-17-22(26)27-25(28-23)32-19-24(31)30(18-21-12-8-5-9-13-21)16-14-20-10-6-4-7-11-20/h4-13,17H,3,14-16,18-19H2,1-2H3