ethyl 2-[4-(phenethylamino)quinazolin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[4-(phenethylamino)quinazolin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[4-(phenethylamino)quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[4-(phenethylamino)-2-quinazolinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(phenethylamino)quinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[4-(phenethylamino)quinazolin-2-yl]thio]acetic acid ethyl ester Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=CC=CC=C2C(=N1)NCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CSC1=NC2=CC=CC=C2C(=N1)NCCC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O2S/c1-2-25-18(24)14-26-20-22-17-11-7-6-10-16(17)19(23-20)21-13-12-15-8-4-3-5-9-15/h3-11H,2,12-14H2,1H3,(H,21,22,23)