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

Systemtic Name: N-(cyclohexylmethyl)-4-methyl-N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-(cyclohexylmethyl)-4-methyl-N-[2-[(4-methylthiazol-2-yl)amino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-(cyclohexylmethyl)-4-methyl-N-[2-[(4-methyl-2-thiazolyl)amino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-(cyclohexylmethyl)-4-methyl-N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-(cyclohexylmethyl)-N-[2-keto-2-[(4-methylthiazol-2-yl)amino]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(CC2CCCCC2)CC(=O)NC3=NC(=CS3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CC2CCCCC2)CC(=O)NC3=NC(=CS3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H26N4O4S/c1-14-8-9-17(10-18(14)25(28)29)20(27)24(11-16-6-4-3-5-7-16)12-19(26)23-21-22-15(2)13-30-21/h8-10,13,16H,3-7,11-12H2,1-2H3,(H,22,23,26)