2,4-dinitro-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 2,4-dinitro-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-2,4-dinitro-benzamide CAS Name: 2,4-dinitro-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-2,4-dinitrobenzamide Traditional Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-2,4-dinitro-benzamide Formula: C16H11N5O5S MolecularWeight: 385.35404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=C(S2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=C(S2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H11N5O5S/c22-15(12-7-6-11(20(23)24)9-13(12)21(25)26)17-16-19-18-14(27-16)8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H,17,19,22)