(1R,2S)-2-cyclohexyl-1-(4-methylsulfonyl-3-nitro-phenyl)-N-(1,3-thiazol-2-yl)cyclopropane-1-carboxamide

Systemtic Name: (1R,2S)-2-cyclohexyl-1-(4-methylsulfonyl-3-nitro-phenyl)-N-(1,3-thiazol-2-yl)cyclopropane-1-carboxamide Openeye Name: (1R,2S)-2-cyclohexyl-1-(4-methylsulfonyl-3-nitro-phenyl)-N-thiazol-2-yl-cyclopropanecarboxamide CAS Name: (1R,2S)-2-cyclohexyl-1-(4-methylsulfonyl-3-nitrophenyl)-N-(2-thiazolyl)-1-cyclopropanecarboxamide IUPAC Name: (1R,2S)-2-cyclohexyl-1-(4-methylsulfonyl-3-nitrophenyl)-N-(1,3-thiazol-2-yl)cyclopropane-1-carboxamide Traditional Name: (1R,2S)-2-cyclohexyl-1-(4-mesyl-3-nitro-phenyl)-N-thiazol-2-yl-cyclopropanecarboxamide Formula: C20H23N3O5S2 MolecularWeight: 449.54372

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)C2(CC2C3CCCCC3)C(=O)NC4=NC=CS4)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)[C@]2(C[C@H]2C3CCCCC3)C(=O)NC4=NC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O5S2/c1-30(27,28)17-8-7-14(11-16(17)23(25)26)20(18(24)22-19-21-9-10-29-19)12-15(20)13-5-3-2-4-6-13/h7-11,13,15H,2-6,12H2,1H3,(H,21,22,24)/t15-,20-/m0/s1