N-(2-methyl-6-nitro-phenyl)-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-(2-methyl-6-nitro-phenyl)-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-(2-methyl-6-nitro-phenyl)-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-(2-methyl-6-nitrophenyl)-2-(4-quinazolinylthio)acetamide IUPAC Name: N-(2-methyl-6-nitrophenyl)-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-(2-methyl-6-nitro-phenyl)-2-(quinazolin-4-ylthio)acetamide Formula: C17H14N4O3S MolecularWeight: 354.38306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)CSC2=NC=NC3=CC=CC=C32

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)CSC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C17H14N4O3S/c1-11-5-4-8-14(21(23)24)16(11)20-15(22)9-25-17-12-6-2-3-7-13(12)18-10-19-17/h2-8,10H,9H2,1H3,(H,20,22)