4-oxidanylidene-4-[2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]ethylamino]butanoate

Systemtic Name: 4-oxidanylidene-4-[2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]ethylamino]butanoate Openeye Name: 4-oxo-4-[2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]ethylamino]butanoate CAS Name: 4-oxo-4-[2-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)amino]ethylamino]butanoate IUPAC Name: 4-oxo-4-[2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]ethylamino]butanoate Traditional Name: 4-keto-4-[2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]ethylamino]butyrate Formula: C18H17N4O3S- MolecularWeight: 369.41758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O3S/c23-14(6-7-15(24)25)19-8-9-20-17-16-13(12-4-2-1-3-5-12)10-26-18(16)22-11-21-17/h1-5,10-11H,6-9H2,(H,19,23)(H,24,25)(H,20,21,22)/p-1