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

Systemtic Name: 4-(4-methylphenyl)-2-[2-(6-methylpyrimidin-4-yl)sulfanylpropanoylamino]thiophene-3-carboxamide Openeye Name: 2-[2-(6-methylpyrimidin-4-yl)sulfanylpropanoylamino]-4-(p-tolyl)thiophene-3-carboxamide CAS Name: 4-(4-methylphenyl)-2-[[2-[(6-methyl-4-pyrimidinyl)thio]-1-oxopropyl]amino]-3-thiophenecarboxamide IUPAC Name: 4-(4-methylphenyl)-2-[2-(6-methylpyrimidin-4-yl)sulfanylpropanoylamino]thiophene-3-carboxamide Traditional Name: 2-[2-[(6-methylpyrimidin-4-yl)thio]propanoylamino]-4-(p-tolyl)thiophene-3-carboxamide Formula: C20H20N4O2S2 MolecularWeight: 412.5284

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C20H20N4O2S2/c1-11-4-6-14(7-5-11)15-9-27-20(17(15)18(21)25)24-19(26)13(3)28-16-8-12(2)22-10-23-16/h4-10,13H,1-3H3,(H2,21,25)(H,24,26)