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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)CSC2=NC3=CC=CC=C3C(=N2)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)CSC2=NC3=CC=CC=C3C(=N2)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H23ClN4OS/c1-30(16-19-7-3-2-4-8-19)23(31)17-32-25-28-22-10-6-5-9-21(22)24(29-25)27-15-18-11-13-20(26)14-12-18/h2-14H,15-17H2,1H3,(H,27,28,29)