3-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylpropanoate

Systemtic Name: 3-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylpropanoate Openeye Name: 3-[2-(morpholinomethyl)quinazolin-4-yl]sulfanylpropanoate CAS Name: 3-[[2-(4-morpholinylmethyl)-4-quinazolinyl]thio]propanoate IUPAC Name: 3-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylpropanoate Traditional Name: 3-[[2-(morpholinomethyl)quinazolin-4-yl]thio]propionate Formula: C16H18N3O3S- MolecularWeight: 332.39742

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=NC3=CC=CC=C3C(=N2)SCCC(=O)[O-]

Isomeric SMILES

C1COCCN1CC2=NC3=CC=CC=C3C(=N2)SCCC(=O)[O-]

InChI

InChI=1S/C16H19N3O3S/c20-15(21)5-10-23-16-12-3-1-2-4-13(12)17-14(18-16)11-19-6-8-22-9-7-19/h1-4H,5-11H2,(H,20,21)/p-1