N-(4-bromanylnaphthalen-1-yl)-2-(5-nitropyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-bromanylnaphthalen-1-yl)-2-(5-nitropyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-bromo-1-naphthyl)-2-[(5-nitro-2-pyridyl)sulfanyl]acetamide CAS Name: N-(4-bromo-1-naphthalenyl)-2-[(5-nitro-2-pyridinyl)thio]acetamide IUPAC Name: N-(4-bromonaphthalen-1-yl)-2-(5-nitropyridin-2-yl)sulfanylacetamide Traditional Name: N-(4-bromo-1-naphthyl)-2-[(5-nitro-2-pyridyl)thio]acetamide Formula: C17H12BrN3O3S MolecularWeight: 418.26448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C2Br)NC(=O)CSC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=C2Br)NC(=O)CSC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H12BrN3O3S/c18-14-6-7-15(13-4-2-1-3-12(13)14)20-16(22)10-25-17-8-5-11(9-19-17)21(23)24/h1-9H,10H2,(H,20,22)