N-[2,5-dimethoxy-4-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]phenyl]benzamide

Systemtic Name: N-[2,5-dimethoxy-4-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]phenyl]benzamide Openeye Name: N-[2,5-dimethoxy-4-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]phenyl]benzamide CAS Name: N-[2,5-dimethoxy-4-[(6-phenyl-4-thieno[2,3-d]pyrimidinyl)amino]phenyl]benzamide IUPAC Name: N-[2,5-dimethoxy-4-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]phenyl]benzamide Traditional Name: N-[2,5-dimethoxy-4-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]phenyl]benzamide Formula: C27H22N4O3S MolecularWeight: 482.55358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC2=C3C=C(SC3=NC=N2)C4=CC=CC=C4)OC)NC(=O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC(=C(C=C1NC2=C3C=C(SC3=NC=N2)C4=CC=CC=C4)OC)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H22N4O3S/c1-33-22-15-21(31-26(32)18-11-7-4-8-12-18)23(34-2)14-20(22)30-25-19-13-24(17-9-5-3-6-10-17)35-27(19)29-16-28-25/h3-16H,1-2H3,(H,31,32)(H,28,29,30)