N-[3-(4-fluorophenyl)sulfanyl-5-nitro-phenyl]quinazolin-4-amine

Systemtic Name: N-[3-(4-fluorophenyl)sulfanyl-5-nitro-phenyl]quinazolin-4-amine Openeye Name: N-[3-(4-fluorophenyl)sulfanyl-5-nitro-phenyl]quinazolin-4-amine CAS Name: N-[3-[(4-fluorophenyl)thio]-5-nitrophenyl]-4-quinazolinamine IUPAC Name: N-[3-(4-fluorophenyl)sulfanyl-5-nitrophenyl]quinazolin-4-amine Traditional Name: [3-[(4-fluorophenyl)thio]-5-nitro-phenyl]-quinazolin-4-yl-amine Formula: C20H13FN4O2S MolecularWeight: 392.406223

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC=N2)NC3=CC(=CC(=C3)SC4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC=N2)NC3=CC(=CC(=C3)SC4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C20H13FN4O2S/c21-13-5-7-16(8-6-13)28-17-10-14(9-15(11-17)25(26)27)24-20-18-3-1-2-4-19(18)22-12-23-20/h1-12H,(H,22,23,24)