methyl 3-(4-phenylazanylquinazolin-2-yl)sulfanylpropanoate

Systemtic Name: methyl 3-(4-phenylazanylquinazolin-2-yl)sulfanylpropanoate Openeye Name: methyl 3-(4-anilinoquinazolin-2-yl)sulfanylpropanoate CAS Name: 3-[(4-anilino-2-quinazolinyl)thio]propanoic acid methyl ester IUPAC Name: methyl 3-(4-anilinoquinazolin-2-yl)sulfanylpropanoate Traditional Name: 3-[(4-anilinoquinazolin-2-yl)thio]propionic acid methyl ester Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=NC2=CC=CC=C2C(=N1)NC3=CC=CC=C3

Isomeric SMILES

COC(=O)CCSC1=NC2=CC=CC=C2C(=N1)NC3=CC=CC=C3

InChI

InChI=1S/C18H17N3O2S/c1-23-16(22)11-12-24-18-20-15-10-6-5-9-14(15)17(21-18)19-13-7-3-2-4-8-13/h2-10H,11-12H2,1H3,(H,19,20,21)