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

Systemtic Name: 2-[4-chloranyl-6-(dipropylamino)pyrimidin-2-yl]sulfanyl-N-phenethyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-chloro-6-(dipropylamino)pyrimidin-2-yl]sulfanyl-N-phenethyl-acetamide CAS Name: 2-[[4-chloro-6-(dipropylamino)-2-pyrimidinyl]thio]-N-phenethyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-chloro-6-(dipropylamino)pyrimidin-2-yl]sulfanyl-N-phenethylacetamide Traditional Name: N-benzyl-2-[[4-chloro-6-(dipropylamino)pyrimidin-2-yl]thio]-N-phenethyl-acetamide Formula: C27H33ClN4OS MolecularWeight: 497.09512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H33ClN4OS/c1-3-16-31(17-4-2)25-19-24(28)29-27(30-25)34-21-26(33)32(20-23-13-9-6-10-14-23)18-15-22-11-7-5-8-12-22/h5-14,19H,3-4,15-18,20-21H2,1-2H3