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

Systemtic Name: N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[2-(2,4-dimethylthiazol-5-yl)ethyl]-4-methyl-3-nitro-benzamide CAS Name: N-[2-(2,4-dimethyl-5-thiazolyl)ethyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[2-(2,4-dimethylthiazol-5-yl)ethyl]-4-methyl-3-nitro-benzamide Formula: C15H17N3O3S MolecularWeight: 319.37878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCC2=C(N=C(S2)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCC2=C(N=C(S2)C)C)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O3S/c1-9-4-5-12(8-13(9)18(20)21)15(19)16-7-6-14-10(2)17-11(3)22-14/h4-5,8H,6-7H2,1-3H3,(H,16,19)