4-tert-butyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzamide

Systemtic Name: 4-tert-butyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzamide Openeye Name: 4-tert-butyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzamide CAS Name: 4-tert-butyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-nitrobenzamide IUPAC Name: 4-tert-butyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-nitrobenzamide Traditional Name: 4-tert-butyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzamide Formula: C16H18N4O3S MolecularWeight: 346.40412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)C(=O)NC2=NN=C(S2)C3CC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)C(=O)NC2=NN=C(S2)C3CC3)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O3S/c1-16(2,3)11-7-6-10(8-12(11)20(22)23)13(21)17-15-19-18-14(24-15)9-4-5-9/h6-9H,4-5H2,1-3H3,(H,17,19,21)