6-bromanyl-N-(3-nitrophenyl)-2-thiophen-2-yl-quinazolin-4-amine

Systemtic Name: 6-bromanyl-N-(3-nitrophenyl)-2-thiophen-2-yl-quinazolin-4-amine Openeye Name: 6-bromo-N-(3-nitrophenyl)-2-(2-thienyl)quinazolin-4-amine CAS Name: 6-bromo-N-(3-nitrophenyl)-2-thiophen-2-yl-4-quinazolinamine IUPAC Name: 6-bromo-N-(3-nitrophenyl)-2-thiophen-2-ylquinazolin-4-amine Traditional Name: [6-bromo-2-(2-thienyl)quinazolin-4-yl]-(3-nitrophenyl)amine Formula: C18H11BrN4O2S MolecularWeight: 427.27454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC2=NC(=NC3=C2C=C(C=C3)Br)C4=CC=CS4

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC2=NC(=NC3=C2C=C(C=C3)Br)C4=CC=CS4

InChI

InChI=1S/C18H11BrN4O2S/c19-11-6-7-15-14(9-11)17(22-18(21-15)16-5-2-8-26-16)20-12-3-1-4-13(10-12)23(24)25/h1-10H,(H,20,21,22)