6-chloranyl-2-[(4-nitrophenyl)methylsulfanyl]-4-phenyl-quinazoline

Systemtic Name: 6-chloranyl-2-[(4-nitrophenyl)methylsulfanyl]-4-phenyl-quinazoline Openeye Name: 6-chloro-2-[(4-nitrophenyl)methylsulfanyl]-4-phenyl-quinazoline CAS Name: 6-chloro-2-[(4-nitrophenyl)methylthio]-4-phenylquinazoline IUPAC Name: 6-chloro-2-[(4-nitrophenyl)methylsulfanyl]-4-phenylquinazoline Traditional Name: 6-chloro-2-[(4-nitrobenzyl)thio]-4-phenyl-quinazoline Formula: C21H14ClN3O2S MolecularWeight: 407.87276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)SCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)SCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H14ClN3O2S/c22-16-8-11-19-18(12-16)20(15-4-2-1-3-5-15)24-21(23-19)28-13-14-6-9-17(10-7-14)25(26)27/h1-12H,13H2