3,5-ditert-butyl-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 3,5-ditert-butyl-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3,5-ditert-butyl-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3,5-ditert-butyl-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3,5-ditert-butyl-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3,5-ditert-butyl-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O3S/c1-22(2,3)16-11-15(12-17(13-16)23(4,5)6)19(28)24-21-26-25-20(31-21)14-7-9-18(10-8-14)27(29)30/h7-13H,1-6H3,(H,24,26,28)