4-nitro-5-(2-propan-2-ylquinazolin-4-yl)sulfanyl-2,1,3-benzothiadiazole

Systemtic Name: 4-nitro-5-(2-propan-2-ylquinazolin-4-yl)sulfanyl-2,1,3-benzothiadiazole Openeye Name: 5-(2-isopropylquinazolin-4-yl)sulfanyl-4-nitro-2,1,3-benzothiadiazole CAS Name: 4-nitro-5-[(2-propan-2-yl-4-quinazolinyl)thio]-2,1,3-benzothiadiazole IUPAC Name: 4-nitro-5-(2-propan-2-ylquinazolin-4-yl)sulfanyl-2,1,3-benzothiadiazole Traditional Name: 5-[(2-isopropylquinazolin-4-yl)thio]-4-nitro-piazthiole Formula: C17H13N5O2S2 MolecularWeight: 383.44742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=N1)SC3=C(C4=NSN=C4C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=N1)SC3=C(C4=NSN=C4C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N5O2S2/c1-9(2)16-18-11-6-4-3-5-10(11)17(19-16)25-13-8-7-12-14(21-26-20-12)15(13)22(23)24/h3-9H,1-2H3