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

Systemtic Name: N-[5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl]-4-methyl-3-nitro-benzamide Openeye Name: N-[5-[(4-chlorophenyl)methyl]thiazol-2-yl]-4-methyl-3-nitro-benzamide CAS Name: N-[5-[(4-chlorophenyl)methyl]-2-thiazolyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl]-4-methyl-3-nitrobenzamide Traditional Name: N-[5-(4-chlorobenzyl)thiazol-2-yl]-4-methyl-3-nitro-benzamide Formula: C18H14ClN3O3S MolecularWeight: 387.84006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=NC=C(S2)CC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=NC=C(S2)CC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H14ClN3O3S/c1-11-2-5-13(9-16(11)22(24)25)17(23)21-18-20-10-15(26-18)8-12-3-6-14(19)7-4-12/h2-7,9-10H,8H2,1H3,(H,20,21,23)