2-[(1S,3R)-2,2-dimethyl-3-[(4-methylphenyl)sulfonylmethyl]cyclohexyl]-N-phenyl-prop-2-enamide

Systemtic Name: 2-[(1S,3R)-2,2-dimethyl-3-[(4-methylphenyl)sulfonylmethyl]cyclohexyl]-N-phenyl-prop-2-enamide Openeye Name: 2-[(1S,3R)-2,2-dimethyl-3-(p-tolylsulfonylmethyl)cyclohexyl]-N-phenyl-prop-2-enamide CAS Name: 2-[(1S,3R)-2,2-dimethyl-3-[(4-methylphenyl)sulfonylmethyl]cyclohexyl]-N-phenyl-2-propenamide IUPAC Name: 2-[(1S,3R)-2,2-dimethyl-3-[(4-methylphenyl)sulfonylmethyl]cyclohexyl]-N-phenylprop-2-enamide Traditional Name: 2-[(1S,3R)-2,2-dimethyl-3-(tosylmethyl)cyclohexyl]-N-phenyl-acrylamide Formula: C25H31NO3S MolecularWeight: 425.58354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2CCCC(C2(C)C)C(=C)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C[C@@H]2CCC[C@@H](C2(C)C)C(=C)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C25H31NO3S/c1-18-13-15-22(16-14-18)30(28,29)17-20-9-8-12-23(25(20,3)4)19(2)24(27)26-21-10-6-5-7-11-21/h5-7,10-11,13-16,20,23H,2,8-9,12,17H2,1,3-4H3,(H,26,27)/t20-,23+/m0/s1