4-tert-butyl-N-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylphenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylphenyl]benzamide Openeye Name: 4-tert-butyl-N-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylphenyl]benzamide CAS Name: 4-tert-butyl-N-[2-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylphenyl]benzamide Traditional Name: 4-tert-butyl-N-[2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)thio]phenyl]benzamide Formula: C29H25N3OS2 MolecularWeight: 495.6583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2SC3=NC=NC4=C3C(=CS4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2SC3=NC=NC4=C3C(=CS4)C5=CC=CC=C5

InChI

InChI=1S/C29H25N3OS2/c1-29(2,3)21-15-13-20(14-16-21)26(33)32-23-11-7-8-12-24(23)35-28-25-22(19-9-5-4-6-10-19)17-34-27(25)30-18-31-28/h4-18H,1-3H3,(H,32,33)