N-[(4-chlorophenyl)methyl]-2-[(4-nitrophenyl)methylsulfanyl]quinazolin-4-amine

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-[(4-nitrophenyl)methylsulfanyl]quinazolin-4-amine Openeye Name: N-[(4-chlorophenyl)methyl]-2-[(4-nitrophenyl)methylsulfanyl]quinazolin-4-amine CAS Name: N-[(4-chlorophenyl)methyl]-2-[(4-nitrophenyl)methylthio]-4-quinazolinamine IUPAC Name: N-[(4-chlorophenyl)methyl]-2-[(4-nitrophenyl)methylsulfanyl]quinazolin-4-amine Traditional Name: (4-chlorobenzyl)-[2-[(4-nitrobenzyl)thio]quinazolin-4-yl]amine Formula: C22H17ClN4O2S MolecularWeight: 436.91398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)SCC3=CC=C(C=C3)[N+](=O)[O-])NCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)SCC3=CC=C(C=C3)[N+](=O)[O-])NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H17ClN4O2S/c23-17-9-5-15(6-10-17)13-24-21-19-3-1-2-4-20(19)25-22(26-21)30-14-16-7-11-18(12-8-16)27(28)29/h1-12H,13-14H2,(H,24,25,26)