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

Systemtic Name: N-[5-(4-tert-butylphenyl)-1,3,4-thiadiazol-2-yl]-2-nitro-benzamide Openeye Name: N-[5-(4-tert-butylphenyl)-1,3,4-thiadiazol-2-yl]-2-nitro-benzamide CAS Name: N-[5-(4-tert-butylphenyl)-1,3,4-thiadiazol-2-yl]-2-nitrobenzamide IUPAC Name: N-[5-(4-tert-butylphenyl)-1,3,4-thiadiazol-2-yl]-2-nitrobenzamide Traditional Name: N-[5-(4-tert-butylphenyl)-1,3,4-thiadiazol-2-yl]-2-nitro-benzamide Formula: C19H18N4O3S MolecularWeight: 382.43622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O3S/c1-19(2,3)13-10-8-12(9-11-13)17-21-22-18(27-17)20-16(24)14-6-4-5-7-15(14)23(25)26/h4-11H,1-3H3,(H,20,22,24)