2-[[4-[(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]phenyl]carbonylamino]ethanoate

Systemtic Name: 2-[[4-[(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]phenyl]carbonylamino]ethanoate Openeye Name: 2-[[4-[(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]benzoyl]amino]acetate CAS Name: 2-[[[4-[(6-methyl-5-phenyl-4-thieno[2,3-d]pyrimidinyl)amino]phenyl]-oxomethyl]amino]acetate IUPAC Name: 2-[[4-[(6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoyl]amino]acetate Traditional Name: 2-[[4-[(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]benzoyl]amino]acetate Formula: C22H17N4O3S- MolecularWeight: 417.46038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N=CN=C2S1)NC3=CC=C(C=C3)C(=O)NCC(=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(N=CN=C2S1)NC3=CC=C(C=C3)C(=O)NCC(=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C22H18N4O3S/c1-13-18(14-5-3-2-4-6-14)19-20(24-12-25-22(19)30-13)26-16-9-7-15(8-10-16)21(29)23-11-17(27)28/h2-10,12H,11H2,1H3,(H,23,29)(H,27,28)(H,24,25,26)/p-1