4-[[4-chloranyl-6-(diethylamino)pyrimidin-2-yl]sulfanylmethyl]-N-(phenylmethyl)benzamide

Systemtic Name: 4-[[4-chloranyl-6-(diethylamino)pyrimidin-2-yl]sulfanylmethyl]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-4-[[4-chloro-6-(diethylamino)pyrimidin-2-yl]sulfanylmethyl]benzamide CAS Name: 4-[[[4-chloro-6-(diethylamino)-2-pyrimidinyl]thio]methyl]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-4-[[4-chloro-6-(diethylamino)pyrimidin-2-yl]sulfanylmethyl]benzamide Traditional Name: N-benzyl-4-[[[4-chloro-6-(diethylamino)pyrimidin-2-yl]thio]methyl]benzamide Formula: C23H25ClN4OS MolecularWeight: 440.9888

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NCC3=CC=CC=C3)Cl

Isomeric SMILES

CCN(CC)C1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NCC3=CC=CC=C3)Cl

InChI

InChI=1S/C23H25ClN4OS/c1-3-28(4-2)21-14-20(24)26-23(27-21)30-16-18-10-12-19(13-11-18)22(29)25-15-17-8-6-5-7-9-17/h5-14H,3-4,15-16H2,1-2H3,(H,25,29)