4-(4-methylphenyl)-2-[3-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanylpropanoylamino]thiophene-3-carboxamide

Systemtic Name: 4-(4-methylphenyl)-2-[3-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanylpropanoylamino]thiophene-3-carboxamide Openeye Name: 2-[3-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanylpropanoylamino]-4-(p-tolyl)thiophene-3-carboxamide CAS Name: 4-(4-methylphenyl)-2-[[3-[(2-methyl-6-phenyl-4-pyrimidinyl)thio]-1-oxopropyl]amino]-3-thiophenecarboxamide IUPAC Name: 4-(4-methylphenyl)-2-[3-(2-methyl-6-phenylpyrimidin-4-yl)sulfanylpropanoylamino]thiophene-3-carboxamide Traditional Name: 2-[3-[(2-methyl-6-phenyl-pyrimidin-4-yl)thio]propanoylamino]-4-(p-tolyl)thiophene-3-carboxamide Formula: C26H24N4O2S2 MolecularWeight: 488.62436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)N)NC(=O)CCSC3=NC(=NC(=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)N)NC(=O)CCSC3=NC(=NC(=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C26H24N4O2S2/c1-16-8-10-18(11-9-16)20-15-34-26(24(20)25(27)32)30-22(31)12-13-33-23-14-21(28-17(2)29-23)19-6-4-3-5-7-19/h3-11,14-15H,12-13H2,1-2H3,(H2,27,32)(H,30,31)