4-methyl-3,5-dinitro-N-[4-(4-propan-2-yloxyphenyl)-1,3-thiazol-2-yl]benzamide

Systemtic Name: 4-methyl-3,5-dinitro-N-[4-(4-propan-2-yloxyphenyl)-1,3-thiazol-2-yl]benzamide Openeye Name: N-[4-(4-isopropoxyphenyl)thiazol-2-yl]-4-methyl-3,5-dinitro-benzamide CAS Name: 4-methyl-3,5-dinitro-N-[4-(4-propan-2-yloxyphenyl)-2-thiazolyl]benzamide IUPAC Name: 4-methyl-3,5-dinitro-N-[4-(4-propan-2-yloxyphenyl)-1,3-thiazol-2-yl]benzamide Traditional Name: N-[4-(4-isopropoxyphenyl)thiazol-2-yl]-4-methyl-3,5-dinitro-benzamide Formula: C20H18N4O6S MolecularWeight: 442.44512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N4O6S/c1-11(2)30-15-6-4-13(5-7-15)16-10-31-20(21-16)22-19(25)14-8-17(23(26)27)12(3)18(9-14)24(28)29/h4-11H,1-3H3,(H,21,22,25)