2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]-7-chloranyl-3-(furan-2-ylmethyl)quinazolin-4-one

Systemtic Name: 2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]-7-chloranyl-3-(furan-2-ylmethyl)quinazolin-4-one Openeye Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]-7-chloro-3-(2-furylmethyl)quinazolin-4-one CAS Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylthio]-7-chloro-3-(2-furanylmethyl)-4-quinazolinone IUPAC Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]-7-chloro-3-(furan-2-ylmethyl)quinazolin-4-one Traditional Name: 2-[(4-amino-6-anilino-s-triazin-2-yl)methylthio]-7-chloro-3-(2-furfuryl)quinazolin-4-one Formula: C23H18ClN7O2S MolecularWeight: 491.95272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3CC5=CC=CO5

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3CC5=CC=CO5

InChI

InChI=1S/C23H18ClN7O2S/c24-14-8-9-17-18(11-14)27-23(31(20(17)32)12-16-7-4-10-33-16)34-13-19-28-21(25)30-22(29-19)26-15-5-2-1-3-6-15/h1-11H,12-13H2,(H3,25,26,28,29,30)