3-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate

Systemtic Name: 3-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Openeye Name: 3-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate CAS Name: 3-[(6-phenyl-4-thieno[2,3-d]pyrimidinyl)amino]benzoate IUPAC Name: 3-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Traditional Name: 3-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Formula: C19H12N3O2S- MolecularWeight: 346.38248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(N=CN=C3S2)NC4=CC=CC(=C4)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(N=CN=C3S2)NC4=CC=CC(=C4)C(=O)[O-]

InChI

InChI=1S/C19H13N3O2S/c23-19(24)13-7-4-8-14(9-13)22-17-15-10-16(12-5-2-1-3-6-12)25-18(15)21-11-20-17/h1-11H,(H,23,24)(H,20,21,22)/p-1