2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]butanamide

Systemtic Name: 2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]butanamide Openeye Name: 2-[(4,8-dimethyl-2-quinolyl)sulfanyl]-N-[4-(3-nitrophenyl)thiazol-2-yl]butanamide CAS Name: 2-[(4,8-dimethyl-2-quinolinyl)thio]-N-[4-(3-nitrophenyl)-2-thiazolyl]butanamide IUPAC Name: 2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]butanamide Traditional Name: 2-[(4,8-dimethyl-2-quinolyl)thio]-N-[4-(3-nitrophenyl)thiazol-2-yl]butyramide Formula: C24H22N4O3S2 MolecularWeight: 478.58648

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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=C(C=CC=C4C)C(=C3)C

Isomeric SMILES

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

InChI

InChI=1S/C24H22N4O3S2/c1-4-20(33-21-11-15(3)18-10-5-7-14(2)22(18)26-21)23(29)27-24-25-19(13-32-24)16-8-6-9-17(12-16)28(30)31/h5-13,20H,4H2,1-3H3,(H,25,27,29)