1-[[2-(4-dimethylaminophenyl)-5-phenyl-thieno[2,3-d]pyrimidin-4-yl]amino]-3-methyl-pyrrole-2,5-dione

Systemtic Name: 1-[[2-(4-dimethylaminophenyl)-5-phenyl-thieno[2,3-d]pyrimidin-4-yl]amino]-3-methyl-pyrrole-2,5-dione Openeye Name: 1-[[2-(4-dimethylaminophenyl)-5-phenyl-thieno[2,3-d]pyrimidin-4-yl]amino]-3-methyl-pyrrole-2,5-dione CAS Name: 1-[[2-(4-dimethylaminophenyl)-5-phenyl-4-thieno[2,3-d]pyrimidinyl]amino]-3-methylpyrrole-2,5-dione IUPAC Name: 1-[[2-(4-dimethylaminophenyl)-5-phenylthieno[2,3-d]pyrimidin-4-yl]amino]-3-methylpyrrole-2,5-dione Traditional Name: 1-[[2-(4-dimethylaminophenyl)-5-phenyl-thieno[2,3-d]pyrimidin-4-yl]amino]-3-methyl-3-pyrroline-2,5-quinone Formula: C25H21N5O2S MolecularWeight: 455.53154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C1=O)NC2=C3C(=CSC3=NC(=N2)C4=CC=C(C=C4)N(C)C)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=O)N(C1=O)NC2=C3C(=CSC3=NC(=N2)C4=CC=C(C=C4)N(C)C)C5=CC=CC=C5

InChI

InChI=1S/C25H21N5O2S/c1-15-13-20(31)30(25(15)32)28-23-21-19(16-7-5-4-6-8-16)14-33-24(21)27-22(26-23)17-9-11-18(12-10-17)29(2)3/h4-14H,1-3H3,(H,26,27,28)