7-bromanyl-4-(6-chloranyl-2-propan-2-yl-quinazolin-4-yl)sulfanyl-5-nitro-2,1,3-benzothiadiazole

Systemtic Name: 7-bromanyl-4-(6-chloranyl-2-propan-2-yl-quinazolin-4-yl)sulfanyl-5-nitro-2,1,3-benzothiadiazole Openeye Name: 7-bromo-4-(6-chloro-2-isopropyl-quinazolin-4-yl)sulfanyl-5-nitro-2,1,3-benzothiadiazole CAS Name: 7-bromo-4-[(6-chloro-2-propan-2-yl-4-quinazolinyl)thio]-5-nitro-2,1,3-benzothiadiazole IUPAC Name: 7-bromo-4-(6-chloro-2-propan-2-ylquinazolin-4-yl)sulfanyl-5-nitro-2,1,3-benzothiadiazole Traditional Name: 7-bromo-4-[(6-chloro-2-isopropyl-quinazolin-4-yl)thio]-5-nitro-piazthiole Formula: C17H11BrClN5O2S2 MolecularWeight: 496.78854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(C=C(C=C2)Cl)C(=N1)SC3=C(C=C(C4=NSN=C34)Br)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=NC2=C(C=C(C=C2)Cl)C(=N1)SC3=C(C=C(C4=NSN=C34)Br)[N+](=O)[O-]

InChI

InChI=1S/C17H11BrClN5O2S2/c1-7(2)16-20-11-4-3-8(19)5-9(11)17(21-16)27-15-12(24(25)26)6-10(18)13-14(15)23-28-22-13/h3-7H,1-2H3