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

Systemtic Name: N-cyclohexyl-N-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-4-methyl-3-nitro-benzamide Openeye Name: N-cyclohexyl-N-[2-[(4,5-dimethylthiazol-2-yl)amino]-2-oxo-ethyl]-4-methyl-3-nitro-benzamide CAS Name: N-cyclohexyl-N-[2-[(4,5-dimethyl-2-thiazolyl)amino]-2-oxoethyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-cyclohexyl-N-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-4-methyl-3-nitrobenzamide Traditional Name: N-cyclohexyl-N-[2-[(4,5-dimethylthiazol-2-yl)amino]-2-keto-ethyl]-4-methyl-3-nitro-benzamide Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(CC(=O)NC2=NC(=C(S2)C)C)C3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CC(=O)NC2=NC(=C(S2)C)C)C3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H26N4O4S/c1-13-9-10-16(11-18(13)25(28)29)20(27)24(17-7-5-4-6-8-17)12-19(26)23-21-22-14(2)15(3)30-21/h9-11,17H,4-8,12H2,1-3H3,(H,22,23,26)