(4-azanylquinazolin-2-yl)methyl 2-naphthalen-2-ylsulfanylethanoate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 2-naphthalen-2-ylsulfanylethanoate Openeye Name: (4-aminoquinazolin-2-yl)methyl 2-(2-naphthylsulfanyl)acetate CAS Name: 2-(2-naphthalenylthio)acetic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 2-naphthalen-2-ylsulfanylacetate Traditional Name: 2-(2-naphthylthio)acetic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C21H17N3O2S MolecularWeight: 375.44358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)SCC(=O)OCC3=NC4=CC=CC=C4C(=N3)N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)SCC(=O)OCC3=NC4=CC=CC=C4C(=N3)N

InChI

InChI=1S/C21H17N3O2S/c22-21-17-7-3-4-8-18(17)23-19(24-21)12-26-20(25)13-27-16-10-9-14-5-1-2-6-15(14)11-16/h1-11H,12-13H2,(H2,22,23,24)