3-(furan-2-ylmethyl)-2-[(2-methoxy-5-nitro-phenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(furan-2-ylmethyl)-2-[(2-methoxy-5-nitro-phenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-(2-furylmethyl)-2-[(2-methoxy-5-nitro-phenyl)methylsulfanyl]quinazolin-4-one CAS Name: 3-(2-furanylmethyl)-2-[(2-methoxy-5-nitrophenyl)methylthio]-4-quinazolinone IUPAC Name: 3-(furan-2-ylmethyl)-2-[(2-methoxy-5-nitrophenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-(2-furfuryl)-2-[(2-methoxy-5-nitro-benzyl)thio]quinazolin-4-one Formula: C21H17N3O5S MolecularWeight: 423.44178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CO4

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CO4

InChI

InChI=1S/C21H17N3O5S/c1-28-19-9-8-15(24(26)27)11-14(19)13-30-21-22-18-7-3-2-6-17(18)20(25)23(21)12-16-5-4-10-29-16/h2-11H,12-13H2,1H3