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

Systemtic Name: N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-methyl-3-nitro-benzamide Openeye Name: N-[4-(4-tert-butylphenyl)thiazol-2-yl]-2-methyl-3-nitro-benzamide CAS Name: N-[4-(4-tert-butylphenyl)-2-thiazolyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-methyl-3-nitrobenzamide Traditional Name: N-[4-(4-tert-butylphenyl)thiazol-2-yl]-2-methyl-3-nitro-benzamide Formula: C21H21N3O3S MolecularWeight: 395.47474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H21N3O3S/c1-13-16(6-5-7-18(13)24(26)27)19(25)23-20-22-17(12-28-20)14-8-10-15(11-9-14)21(2,3)4/h5-12H,1-4H3,(H,22,23,25)