4-[[4-(diethylamino)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-ethyl-benzamide

Systemtic Name: 4-[[4-(diethylamino)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-ethyl-benzamide Openeye Name: 4-[[4-(diethylamino)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-ethyl-benzamide CAS Name: 4-[[[4-(diethylamino)-6-phenyl-2-pyrimidinyl]thio]methyl]-N-ethylbenzamide IUPAC Name: 4-[[4-(diethylamino)-6-phenylpyrimidin-2-yl]sulfanylmethyl]-N-ethylbenzamide Traditional Name: 4-[[[4-(diethylamino)-6-phenyl-pyrimidin-2-yl]thio]methyl]-N-ethyl-benzamide Formula: C24H28N4OS MolecularWeight: 420.57032

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)N(CC)CC)C3=CC=CC=C3

Isomeric SMILES

CCNC(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)N(CC)CC)C3=CC=CC=C3

InChI

InChI=1S/C24H28N4OS/c1-4-25-23(29)20-14-12-18(13-15-20)17-30-24-26-21(19-10-8-7-9-11-19)16-22(27-24)28(5-2)6-3/h7-16H,4-6,17H2,1-3H3,(H,25,29)