2-(4-chloranyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanyl-N-[(2S)-5-(diethylamino)pentan-2-yl]ethanamide

Systemtic Name: 2-(4-chloranyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanyl-N-[(2S)-5-(diethylamino)pentan-2-yl]ethanamide Openeye Name: 2-(4-chloro-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanyl-N-[(1S)-4-(diethylamino)-1-methyl-butyl]acetamide CAS Name: 2-[[4-chloro-6-(1-pyrrolidinyl)-2-pyrimidinyl]thio]-N-[(2S)-5-(diethylamino)pentan-2-yl]acetamide IUPAC Name: 2-(4-chloro-6-pyrrolidin-1-ylpyrimidin-2-yl)sulfanyl-N-[(2S)-5-(diethylamino)pentan-2-yl]acetamide Traditional Name: 2-[(4-chloro-6-pyrrolidino-pyrimidin-2-yl)thio]-N-[(1S)-4-(diethylamino)-1-methyl-butyl]acetamide Formula: C19H32ClN5OS MolecularWeight: 414.00828

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC(=O)CSC1=NC(=CC(=N1)Cl)N2CCCC2

Isomeric SMILES

CCN(CC)CCC[C@H](C)NC(=O)CSC1=NC(=CC(=N1)Cl)N2CCCC2

InChI

InChI=1S/C19H32ClN5OS/c1-4-24(5-2)10-8-9-15(3)21-18(26)14-27-19-22-16(20)13-17(23-19)25-11-6-7-12-25/h13,15H,4-12,14H2,1-3H3,(H,21,26)/t15-/m0/s1