N-[3-[[2-(1,3-benzothiazol-2-ylmethyl)-2-ethyl-butanoyl]amino]phenyl]furan-2-carboxamide

Systemtic Name: N-[3-[[2-(1,3-benzothiazol-2-ylmethyl)-2-ethyl-butanoyl]amino]phenyl]furan-2-carboxamide Openeye Name: N-[3-[[2-(1,3-benzothiazol-2-ylmethyl)-2-ethyl-butanoyl]amino]phenyl]furan-2-carboxamide CAS Name: N-[3-[[2-(1,3-benzothiazol-2-ylmethyl)-2-ethyl-1-oxobutyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[3-[[2-(1,3-benzothiazol-2-ylmethyl)-2-ethylbutanoyl]amino]phenyl]furan-2-carboxamide Traditional Name: N-[3-[[2-(1,3-benzothiazol-2-ylmethyl)-2-ethyl-butanoyl]amino]phenyl]-2-furamide Formula: C25H25N3O3S MolecularWeight: 447.5493

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC1=NC2=CC=CC=C2S1)C(=O)NC3=CC=CC(=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

CCC(CC)(CC1=NC2=CC=CC=C2S1)C(=O)NC3=CC=CC(=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C25H25N3O3S/c1-3-25(4-2,16-22-28-19-11-5-6-13-21(19)32-22)24(30)27-18-10-7-9-17(15-18)26-23(29)20-12-8-14-31-20/h5-15H,3-4,16H2,1-2H3,(H,26,29)(H,27,30)