N-tert-butyl-4-methyl-3-nitro-N-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]benzamide

Systemtic Name: N-tert-butyl-4-methyl-3-nitro-N-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]benzamide Openeye Name: N-tert-butyl-4-methyl-3-nitro-N-[2-oxo-2-(thiazol-2-ylamino)ethyl]benzamide CAS Name: N-tert-butyl-4-methyl-3-nitro-N-[2-oxo-2-(2-thiazolylamino)ethyl]benzamide IUPAC Name: N-tert-butyl-4-methyl-3-nitro-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]benzamide Traditional Name: N-tert-butyl-N-[2-keto-2-(thiazol-2-ylamino)ethyl]-4-methyl-3-nitro-benzamide Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(CC(=O)NC2=NC=CS2)C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CC(=O)NC2=NC=CS2)C(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O4S/c1-11-5-6-12(9-13(11)21(24)25)15(23)20(17(2,3)4)10-14(22)19-16-18-7-8-26-16/h5-9H,10H2,1-4H3,(H,18,19,22)