ethyl 2-[4-[(4-chlorophenyl)methylamino]quinazolin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[4-[(4-chlorophenyl)methylamino]quinazolin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[4-[(4-chlorophenyl)methylamino]quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[4-[(4-chlorophenyl)methylamino]-2-quinazolinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(4-chlorophenyl)methylamino]quinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[4-[(4-chlorobenzyl)amino]quinazolin-2-yl]thio]acetic acid ethyl ester Formula: C19H18ClN3O2S MolecularWeight: 387.88312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=CC=CC=C2C(=N1)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)CSC1=NC2=CC=CC=C2C(=N1)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H18ClN3O2S/c1-2-25-17(24)12-26-19-22-16-6-4-3-5-15(16)18(23-19)21-11-13-7-9-14(20)10-8-13/h3-10H,2,11-12H2,1H3,(H,21,22,23)