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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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