4-(4-methylphenyl)-2-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoylamino]thiophene-3-carboxamide

Systemtic Name: 4-(4-methylphenyl)-2-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoylamino]thiophene-3-carboxamide Openeye Name: 2-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoylamino]-4-(p-tolyl)thiophene-3-carboxamide CAS Name: 4-(4-methylphenyl)-2-[[1-oxo-2-[(6-phenyl-4-pyrimidinyl)thio]propyl]amino]-3-thiophenecarboxamide IUPAC Name: 4-(4-methylphenyl)-2-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoylamino]thiophene-3-carboxamide Traditional Name: 2-[2-[(6-phenylpyrimidin-4-yl)thio]propanoylamino]-4-(p-tolyl)thiophene-3-carboxamide Formula: C25H22N4O2S2 MolecularWeight: 474.59778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)N)NC(=O)C(C)SC3=NC=NC(=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)N)NC(=O)C(C)SC3=NC=NC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H22N4O2S2/c1-15-8-10-17(11-9-15)19-13-32-25(22(19)23(26)30)29-24(31)16(2)33-21-12-20(27-14-28-21)18-6-4-3-5-7-18/h3-14,16H,1-2H3,(H2,26,30)(H,29,31)