N-[(2-chlorophenyl)methyl]-2-[4-(phenethylamino)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-2-[4-(phenethylamino)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[(2-chlorophenyl)methyl]-2-[4-(phenethylamino)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[(2-chlorophenyl)methyl]-2-[[4-(phenethylamino)-2-quinazolinyl]thio]acetamide IUPAC Name: N-[(2-chlorophenyl)methyl]-2-[4-(phenethylamino)quinazolin-2-yl]sulfanylacetamide Traditional Name: N-(2-chlorobenzyl)-2-[[4-(phenethylamino)quinazolin-2-yl]thio]acetamide Formula: C25H23ClN4OS MolecularWeight: 462.99432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=NC(=NC3=CC=CC=C32)SCC(=O)NCC4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=NC(=NC3=CC=CC=C32)SCC(=O)NCC4=CC=CC=C4Cl

InChI

InChI=1S/C25H23ClN4OS/c26-21-12-6-4-10-19(21)16-28-23(31)17-32-25-29-22-13-7-5-11-20(22)24(30-25)27-15-14-18-8-2-1-3-9-18/h1-13H,14-17H2,(H,28,31)(H,27,29,30)