6-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]hexanoate

Systemtic Name: 6-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]hexanoate Openeye Name: 6-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]hexanoate CAS Name: 6-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)amino]hexanoate IUPAC Name: 6-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]hexanoate Traditional Name: 6-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]hexanoate Formula: C18H18N3O2S- MolecularWeight: 340.41942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NCCCCCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NCCCCCC(=O)[O-]

InChI

InChI=1S/C18H19N3O2S/c22-15(23)9-5-2-6-10-19-17-16-14(13-7-3-1-4-8-13)11-24-18(16)21-12-20-17/h1,3-4,7-8,11-12H,2,5-6,9-10H2,(H,22,23)(H,19,20,21)/p-1