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

Systemtic Name: N-(4-chloranyl-3-nitro-phenyl)-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-(4-chloro-3-nitro-phenyl)-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-(4-chloro-3-nitrophenyl)-2-(4-quinazolinylthio)acetamide IUPAC Name: N-(4-chloro-3-nitrophenyl)-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-(4-chloro-3-nitro-phenyl)-2-(quinazolin-4-ylthio)acetamide Formula: C16H11ClN4O3S MolecularWeight: 374.80154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC=N2)SCC(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC=N2)SCC(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H11ClN4O3S/c17-12-6-5-10(7-14(12)21(23)24)20-15(22)8-25-16-11-3-1-2-4-13(11)18-9-19-16/h1-7,9H,8H2,(H,20,22)