N-(4-tert-butyl-1,3-thiazol-2-yl)-4-(2-methoxyethylamino)-3-nitro-benzamide

Systemtic Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-4-(2-methoxyethylamino)-3-nitro-benzamide Openeye Name: N-(4-tert-butylthiazol-2-yl)-4-(2-methoxyethylamino)-3-nitro-benzamide CAS Name: N-(4-tert-butyl-2-thiazolyl)-4-(2-methoxyethylamino)-3-nitrobenzamide IUPAC Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-4-(2-methoxyethylamino)-3-nitrobenzamide Traditional Name: N-(4-tert-butylthiazol-2-yl)-4-(2-methoxyethylamino)-3-nitro-benzamide Formula: C17H22N4O4S MolecularWeight: 378.44598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)NC(=O)C2=CC(=C(C=C2)NCCOC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)NC(=O)C2=CC(=C(C=C2)NCCOC)[N+](=O)[O-]

InChI

InChI=1S/C17H22N4O4S/c1-17(2,3)14-10-26-16(19-14)20-15(22)11-5-6-12(18-7-8-25-4)13(9-11)21(23)24/h5-6,9-10,18H,7-8H2,1-4H3,(H,19,20,22)