N-(furan-2-ylmethyl)-2-[(3-nitrophenyl)methylsulfanyl]quinazolin-4-amine

Systemtic Name: N-(furan-2-ylmethyl)-2-[(3-nitrophenyl)methylsulfanyl]quinazolin-4-amine Openeye Name: N-(2-furylmethyl)-2-[(3-nitrophenyl)methylsulfanyl]quinazolin-4-amine CAS Name: N-(2-furanylmethyl)-2-[(3-nitrophenyl)methylthio]-4-quinazolinamine IUPAC Name: N-(furan-2-ylmethyl)-2-[(3-nitrophenyl)methylsulfanyl]quinazolin-4-amine Traditional Name: 2-furfuryl-[2-[(3-nitrobenzyl)thio]quinazolin-4-yl]amine Formula: C20H16N4O3S MolecularWeight: 392.43104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)SCC3=CC(=CC=C3)[N+](=O)[O-])NCC4=CC=CO4

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)SCC3=CC(=CC=C3)[N+](=O)[O-])NCC4=CC=CO4

InChI

InChI=1S/C20H16N4O3S/c25-24(26)15-6-3-5-14(11-15)13-28-20-22-18-9-2-1-8-17(18)19(23-20)21-12-16-7-4-10-27-16/h1-11H,12-13H2,(H,21,22,23)