2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)azaniumyl]ethanoate

Systemtic Name: 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)azaniumyl]ethanoate Openeye Name: 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)ammonio]acetate CAS Name: 2-[(6-phenyl-4-thieno[2,3-d]pyrimidinyl)ammonio]acetate IUPAC Name: 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)azaniumyl]acetate Traditional Name: 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)ammonio]acetate Formula: C14H11N3O2S MolecularWeight: 285.32104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(N=CN=C3S2)[NH2+]CC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(N=CN=C3S2)[NH2+]CC(=O)[O-]

InChI

InChI=1S/C14H11N3O2S/c18-12(19)7-15-13-10-6-11(9-4-2-1-3-5-9)20-14(10)17-8-16-13/h1-6,8H,7H2,(H,18,19)(H,15,16,17)