(4-azanylquinazolin-2-yl)methyl 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate Openeye Name: (4-aminoquinazolin-2-yl)methyl 2-(4,5-dihydrothiazol-2-ylsulfanylmethyl)benzoate CAS Name: 2-[(4,5-dihydrothiazol-2-ylthio)methyl]benzoic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate Traditional Name: 2-[(2-thiazolin-2-ylthio)methyl]benzoic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C20H18N4O2S2 MolecularWeight: 410.51252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=N1)SCC2=CC=CC=C2C(=O)OCC3=NC4=CC=CC=C4C(=N3)N

Isomeric SMILES

C1CSC(=N1)SCC2=CC=CC=C2C(=O)OCC3=NC4=CC=CC=C4C(=N3)N

InChI

InChI=1S/C20H18N4O2S2/c21-18-15-7-3-4-8-16(15)23-17(24-18)11-26-19(25)14-6-2-1-5-13(14)12-28-20-22-9-10-27-20/h1-8H,9-12H2,(H2,21,23,24)