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

Systemtic Name: 2-[4-chloranyl-6-(diethylamino)pyrimidin-2-yl]sulfanyl-N-(2-dimethylaminoethyl)-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-chloro-6-(diethylamino)pyrimidin-2-yl]sulfanyl-N-(2-dimethylaminoethyl)acetamide CAS Name: 2-[[4-chloro-6-(diethylamino)-2-pyrimidinyl]thio]-N-(2-dimethylaminoethyl)-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-chloro-6-(diethylamino)pyrimidin-2-yl]sulfanyl-N-(2-dimethylaminoethyl)acetamide Traditional Name: N-benzyl-2-[[4-chloro-6-(diethylamino)pyrimidin-2-yl]thio]-N-(2-dimethylaminoethyl)acetamide Formula: C21H30ClN5OS MolecularWeight: 436.0138

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=NC(=N1)SCC(=O)N(CCN(C)C)CC2=CC=CC=C2)Cl

Isomeric SMILES

CCN(CC)C1=CC(=NC(=N1)SCC(=O)N(CCN(C)C)CC2=CC=CC=C2)Cl

InChI

InChI=1S/C21H30ClN5OS/c1-5-26(6-2)19-14-18(22)23-21(24-19)29-16-20(28)27(13-12-25(3)4)15-17-10-8-7-9-11-17/h7-11,14H,5-6,12-13,15-16H2,1-4H3