4-methyl-3-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate

Systemtic Name: 4-methyl-3-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Openeye Name: 4-methyl-3-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate CAS Name: 4-methyl-3-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)amino]benzoate IUPAC Name: 4-methyl-3-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Traditional Name: 4-methyl-3-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Formula: C20H14N3O2S- MolecularWeight: 360.40906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])NC2=C3C(=CSC3=NC=N2)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])NC2=C3C(=CSC3=NC=N2)C4=CC=CC=C4

InChI

InChI=1S/C20H15N3O2S/c1-12-7-8-14(20(24)25)9-16(12)23-18-17-15(13-5-3-2-4-6-13)10-26-19(17)22-11-21-18/h2-11H,1H3,(H,24,25)(H,21,22,23)/p-1