N-(4-chloranyl-3-nitro-phenyl)-2-phenyl-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-(4-chloranyl-3-nitro-phenyl)-2-phenyl-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-(4-chloro-3-nitro-phenyl)-2-phenyl-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-(4-chloro-3-nitrophenyl)-2-phenyl-2-(4-quinazolinylthio)acetamide IUPAC Name: N-(4-chloro-3-nitrophenyl)-2-phenyl-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-(4-chloro-3-nitro-phenyl)-2-phenyl-2-(quinazolin-4-ylthio)acetamide Formula: C22H15ClN4O3S MolecularWeight: 450.8975

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])SC3=NC=NC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])SC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C22H15ClN4O3S/c23-17-11-10-15(12-19(17)27(29)30)26-21(28)20(14-6-2-1-3-7-14)31-22-16-8-4-5-9-18(16)24-13-25-22/h1-13,20H,(H,26,28)