1,3-diethyl-5-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoyl]benzimidazol-2-one

Systemtic Name: 1,3-diethyl-5-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoyl]benzimidazol-2-one Openeye Name: 1,3-diethyl-5-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoyl]benzimidazol-2-one CAS Name: 1,3-diethyl-5-[1-oxo-2-[(6-phenyl-4-pyrimidinyl)thio]propyl]-2-benzimidazolone IUPAC Name: 1,3-diethyl-5-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoyl]benzimidazol-2-one Traditional Name: 1,3-diethyl-5-[2-[(6-phenylpyrimidin-4-yl)thio]propanoyl]benzimidazol-2-one Formula: C24H24N4O2S MolecularWeight: 432.53796

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)C(C)SC3=NC=NC(=C3)C4=CC=CC=C4)N(C1=O)CC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)C(C)SC3=NC=NC(=C3)C4=CC=CC=C4)N(C1=O)CC

InChI

InChI=1S/C24H24N4O2S/c1-4-27-20-12-11-18(13-21(20)28(5-2)24(27)30)23(29)16(3)31-22-14-19(25-15-26-22)17-9-7-6-8-10-17/h6-16H,4-5H2,1-3H3