N-tert-butyl-4-[3-[5-(4-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoylamino]benzamide

Systemtic Name: N-tert-butyl-4-[3-[5-(4-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoylamino]benzamide Openeye Name: N-tert-butyl-4-[3-[4-oxo-5-(p-tolyl)thieno[2,3-d]pyrimidin-3-yl]propanoylamino]benzamide CAS Name: N-tert-butyl-4-[[3-[5-(4-methylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]-1-oxopropyl]amino]benzamide IUPAC Name: N-tert-butyl-4-[3-[5-(4-methylphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoylamino]benzamide Traditional Name: N-tert-butyl-4-[3-[4-keto-5-(p-tolyl)thieno[2,3-d]pyrimidin-3-yl]propanoylamino]benzamide Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CCC(=O)NC4=CC=C(C=C4)C(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CCC(=O)NC4=CC=C(C=C4)C(=O)NC(C)(C)C

InChI

InChI=1S/C27H28N4O3S/c1-17-5-7-18(8-6-17)21-15-35-25-23(21)26(34)31(16-28-25)14-13-22(32)29-20-11-9-19(10-12-20)24(33)30-27(2,3)4/h5-12,15-16H,13-14H2,1-4H3,(H,29,32)(H,30,33)