3-methyl-N-[[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methyl]-4-nitro-benzamide

Systemtic Name: 3-methyl-N-[[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methyl]-4-nitro-benzamide Openeye Name: 3-methyl-N-[[5-(2-methylthiazol-4-yl)-2-furyl]methyl]-4-nitro-benzamide CAS Name: 3-methyl-N-[[5-(2-methyl-4-thiazolyl)-2-furanyl]methyl]-4-nitrobenzamide IUPAC Name: 3-methyl-N-[[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methyl]-4-nitrobenzamide Traditional Name: 3-methyl-N-[[5-(2-methylthiazol-4-yl)-2-furyl]methyl]-4-nitro-benzamide Formula: C17H15N3O4S MolecularWeight: 357.3837

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC2=CC=C(O2)C3=CSC(=N3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC2=CC=C(O2)C3=CSC(=N3)C)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O4S/c1-10-7-12(3-5-15(10)20(22)23)17(21)18-8-13-4-6-16(24-13)14-9-25-11(2)19-14/h3-7,9H,8H2,1-2H3,(H,18,21)