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

Systemtic Name: 2-[4-chloranyl-6-[methyl-(phenylmethyl)amino]pyrimidin-2-yl]sulfanyl-N,N-dipropyl-ethanamide Openeye Name: 2-[4-[benzyl(methyl)amino]-6-chloro-pyrimidin-2-yl]sulfanyl-N,N-dipropyl-acetamide CAS Name: 2-[[4-chloro-6-[methyl-(phenylmethyl)amino]-2-pyrimidinyl]thio]-N,N-dipropylacetamide IUPAC Name: 2-[4-[benzyl(methyl)amino]-6-chloropyrimidin-2-yl]sulfanyl-N,N-dipropylacetamide Traditional Name: 2-[[4-[benzyl(methyl)amino]-6-chloro-pyrimidin-2-yl]thio]-N,N-dipropyl-acetamide Formula: C20H27ClN4OS MolecularWeight: 406.97258

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)CSC1=NC(=CC(=N1)Cl)N(C)CC2=CC=CC=C2

Isomeric SMILES

CCCN(CCC)C(=O)CSC1=NC(=CC(=N1)Cl)N(C)CC2=CC=CC=C2

InChI

InChI=1S/C20H27ClN4OS/c1-4-11-25(12-5-2)19(26)15-27-20-22-17(21)13-18(23-20)24(3)14-16-9-7-6-8-10-16/h6-10,13H,4-5,11-12,14-15H2,1-3H3