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

Systemtic Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-quinolin-2-ylsulfanyl-propanamide Openeye Name: N-[4-(3-nitrophenyl)thiazol-2-yl]-3-(2-quinolylsulfanyl)propanamide CAS Name: N-[4-(3-nitrophenyl)-2-thiazolyl]-3-(2-quinolinylthio)propanamide IUPAC Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-quinolin-2-ylsulfanylpropanamide Traditional Name: N-[4-(3-nitrophenyl)thiazol-2-yl]-3-(2-quinolylthio)propionamide Formula: C21H16N4O3S2 MolecularWeight: 436.50674

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16N4O3S2/c26-19(10-11-29-20-9-8-14-4-1-2-7-17(14)22-20)24-21-23-18(13-30-21)15-5-3-6-16(12-15)25(27)28/h1-9,12-13H,10-11H2,(H,23,24,26)