N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-nitro-cyclopropane-1-carboxamide

Systemtic Name: N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-nitro-cyclopropane-1-carboxamide Openeye Name: N-[4-(4-tert-butylphenyl)thiazol-2-yl]-2-nitro-cyclopropanecarboxamide CAS Name: N-[4-(4-tert-butylphenyl)-2-thiazolyl]-2-nitro-1-cyclopropanecarboxamide IUPAC Name: N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-nitrocyclopropane-1-carboxamide Traditional Name: N-[4-(4-tert-butylphenyl)thiazol-2-yl]-2-nitro-cyclopropanecarboxamide Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3CC3[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3CC3[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O3S/c1-17(2,3)11-6-4-10(5-7-11)13-9-24-16(18-13)19-15(21)12-8-14(12)20(22)23/h4-7,9,12,14H,8H2,1-3H3,(H,18,19,21)