N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-butanamide

Systemtic Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-butanamide Openeye Name: N-[4-(3-nitrophenyl)thiazol-2-yl]-2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]butanamide CAS Name: N-[4-(3-nitrophenyl)-2-thiazolyl]-2-[(4,6,8-trimethyl-2-quinolinyl)thio]butanamide IUPAC Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-(4,6,8-trimethylquinolin-2-yl)sulfanylbutanamide Traditional Name: N-[4-(3-nitrophenyl)thiazol-2-yl]-2-[(4,6,8-trimethyl-2-quinolyl)thio]butyramide Formula: C25H24N4O3S2 MolecularWeight: 492.61306

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

Isomeric SMILES

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

InChI

InChI=1S/C25H24N4O3S2/c1-5-21(34-22-11-15(3)19-10-14(2)9-16(4)23(19)27-22)24(30)28-25-26-20(13-33-25)17-7-6-8-18(12-17)29(31)32/h6-13,21H,5H2,1-4H3,(H,26,28,30)