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

Systemtic Name: N-[5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl]-3-methyl-4-nitro-benzamide Openeye Name: N-[5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl]-3-methyl-4-nitro-benzamide CAS Name: N-[5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl]-3-methyl-4-nitrobenzamide IUPAC Name: N-[5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl]-3-methyl-4-nitrobenzamide Traditional Name: N-[5-(4-chlorobenzyl)-1,3,4-thiadiazol-2-yl]-3-methyl-4-nitro-benzamide Formula: C17H13ClN4O3S MolecularWeight: 388.82812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13ClN4O3S/c1-10-8-12(4-7-14(10)22(24)25)16(23)19-17-21-20-15(26-17)9-11-2-5-13(18)6-3-11/h2-8H,9H2,1H3,(H,19,21,23)