2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]-3-(2-chlorophenyl)quinazolin-4-one

Systemtic Name: 2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]-3-(2-chlorophenyl)quinazolin-4-one Openeye Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]-3-(2-chlorophenyl)quinazolin-4-one CAS Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylthio]-3-(2-chlorophenyl)-4-quinazolinone IUPAC Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]-3-(2-chlorophenyl)quinazolin-4-one Traditional Name: 2-[(4-amino-6-anilino-s-triazin-2-yl)methylthio]-3-(2-chlorophenyl)quinazolin-4-one Formula: C24H18ClN7OS MolecularWeight: 487.96402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5Cl

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5Cl

InChI

InChI=1S/C24H18ClN7OS/c25-17-11-5-7-13-19(17)32-21(33)16-10-4-6-12-18(16)28-24(32)34-14-20-29-22(26)31-23(30-20)27-15-8-2-1-3-9-15/h1-13H,14H2,(H3,26,27,29,30,31)