N-[4-methyl-5-(2-methylbutan-2-yl)-1,3-thiazol-2-yl]-4-nitro-benzamide

Systemtic Name: N-[4-methyl-5-(2-methylbutan-2-yl)-1,3-thiazol-2-yl]-4-nitro-benzamide Openeye Name: N-[5-(1,1-dimethylpropyl)-4-methyl-thiazol-2-yl]-4-nitro-benzamide CAS Name: N-[4-methyl-5-(2-methylbutan-2-yl)-2-thiazolyl]-4-nitrobenzamide IUPAC Name: N-[4-methyl-5-(2-methylbutan-2-yl)-1,3-thiazol-2-yl]-4-nitrobenzamide Traditional Name: N-(5-tert-amyl-4-methyl-thiazol-2-yl)-4-nitro-benzamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=C(N=C(S1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCC(C)(C)C1=C(N=C(S1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C16H19N3O3S/c1-5-16(3,4)13-10(2)17-15(23-13)18-14(20)11-6-8-12(9-7-11)19(21)22/h6-9H,5H2,1-4H3,(H,17,18,20)