N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-quinolin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-quinolin-2-ylsulfanyl-ethanamide Openeye Name: N-[4-(3-nitrophenyl)thiazol-2-yl]-2-(2-quinolylsulfanyl)acetamide CAS Name: N-[4-(3-nitrophenyl)-2-thiazolyl]-2-(2-quinolinylthio)acetamide IUPAC Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-quinolin-2-ylsulfanylacetamide Traditional Name: N-[4-(3-nitrophenyl)thiazol-2-yl]-2-(2-quinolylthio)acetamide Formula: C20H14N4O3S2 MolecularWeight: 422.48016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)SCC(=O)NC3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)SCC(=O)NC3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H14N4O3S2/c25-18(12-28-19-9-8-13-4-1-2-7-16(13)21-19)23-20-22-17(11-29-20)14-5-3-6-15(10-14)24(26)27/h1-11H,12H2,(H,22,23,25)