N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-chloranyl-5-nitro-benzamide

Systemtic Name: N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-chloranyl-5-nitro-benzamide Openeye Name: N-[4-(4-tert-butylphenyl)thiazol-2-yl]-2-chloro-5-nitro-benzamide CAS Name: N-[4-(4-tert-butylphenyl)-2-thiazolyl]-2-chloro-5-nitrobenzamide IUPAC Name: N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-chloro-5-nitrobenzamide Traditional Name: N-[4-(4-tert-butylphenyl)thiazol-2-yl]-2-chloro-5-nitro-benzamide Formula: C20H18ClN3O3S MolecularWeight: 415.89322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H18ClN3O3S/c1-20(2,3)13-6-4-12(5-7-13)17-11-28-19(22-17)23-18(25)15-10-14(24(26)27)8-9-16(15)21/h4-11H,1-3H3,(H,22,23,25)