N-(2-methylpropyl)-N-[2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-4-nitro-benzamide

Systemtic Name: N-(2-methylpropyl)-N-[2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-4-nitro-benzamide Openeye Name: N-isobutyl-N-[2-[(5-methylthiazol-2-yl)amino]-2-oxo-ethyl]-4-nitro-benzamide CAS Name: N-(2-methylpropyl)-N-[2-[(5-methyl-2-thiazolyl)amino]-2-oxoethyl]-4-nitrobenzamide IUPAC Name: N-(2-methylpropyl)-N-[2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-4-nitrobenzamide Traditional Name: N-isobutyl-N-[2-keto-2-[(5-methylthiazol-2-yl)amino]ethyl]-4-nitro-benzamide Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(S1)NC(=O)CN(CC(C)C)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CN=C(S1)NC(=O)CN(CC(C)C)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O4S/c1-11(2)9-20(10-15(22)19-17-18-8-12(3)26-17)16(23)13-4-6-14(7-5-13)21(24)25/h4-8,11H,9-10H2,1-3H3,(H,18,19,22)