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

Systemtic Name: 2-(4-methylquinolin-2-yl)sulfanyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]butanamide Openeye Name: 2-[(4-methyl-2-quinolyl)sulfanyl]-N-[4-(3-nitrophenyl)thiazol-2-yl]butanamide CAS Name: 2-[(4-methyl-2-quinolinyl)thio]-N-[4-(3-nitrophenyl)-2-thiazolyl]butanamide IUPAC Name: 2-(4-methylquinolin-2-yl)sulfanyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]butanamide Traditional Name: 2-[(4-methyl-2-quinolyl)thio]-N-[4-(3-nitrophenyl)thiazol-2-yl]butyramide Formula: C23H20N4O3S2 MolecularWeight: 464.5599

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C23H20N4O3S2/c1-3-20(32-21-11-14(2)17-9-4-5-10-18(17)24-21)22(28)26-23-25-19(13-31-23)15-7-6-8-16(12-15)27(29)30/h4-13,20H,3H2,1-2H3,(H,25,26,28)