tert-butyl 2-[4-(ethylamino)quinazolin-2-yl]sulfanylethanoate

Systemtic Name: tert-butyl 2-[4-(ethylamino)quinazolin-2-yl]sulfanylethanoate Openeye Name: tert-butyl 2-[4-(ethylamino)quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[4-(ethylamino)-2-quinazolinyl]thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-(ethylamino)quinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[4-(ethylamino)quinazolin-2-yl]thio]acetic acid tert-butyl ester Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)OC(C)(C)C

Isomeric SMILES

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)OC(C)(C)C

InChI

InChI=1S/C16H21N3O2S/c1-5-17-14-11-8-6-7-9-12(11)18-15(19-14)22-10-13(20)21-16(2,3)4/h6-9H,5,10H2,1-4H3,(H,17,18,19)