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

Systemtic Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-quinolin-2-ylsulfanyl-butanamide Openeye Name: N-[4-(3-nitrophenyl)thiazol-2-yl]-2-(2-quinolylsulfanyl)butanamide CAS Name: N-[4-(3-nitrophenyl)-2-thiazolyl]-2-(2-quinolinylthio)butanamide IUPAC Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-quinolin-2-ylsulfanylbutanamide Traditional Name: N-[4-(3-nitrophenyl)thiazol-2-yl]-2-(2-quinolylthio)butyramide Formula: C22H18N4O3S2 MolecularWeight: 450.53332

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC(=CS1)C2=CC(=CC=C2)[N+](=O)[O-])SC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CCC(C(=O)NC1=NC(=CS1)C2=CC(=CC=C2)[N+](=O)[O-])SC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H18N4O3S2/c1-2-19(31-20-11-10-14-6-3-4-9-17(14)23-20)21(27)25-22-24-18(13-30-22)15-7-5-8-16(12-15)26(28)29/h3-13,19H,2H2,1H3,(H,24,25,27)