N-[(1R,3R,4R)-3-bicyclo[2.2.1]heptanyl]-2-[(4-chloranyl-2-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-[(1R,3R,4R)-3-bicyclo[2.2.1]heptanyl]-2-[(4-chloranyl-2-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]ethanamide Openeye Name: 2-[4-chloro-2-methyl-N-(p-tolylsulfonyl)anilino]-N-[(1R,2R,4R)-norbornan-2-yl]acetamide CAS Name: N-[(1R,3R,4R)-3-bicyclo[2.2.1]heptanyl]-2-(4-chloro-2-methyl-N-(4-methylphenyl)sulfonylanilino)acetamide IUPAC Name: N-[(1R,3R,4R)-3-bicyclo[2.2.1]heptanyl]-2-(4-chloro-2-methyl-N-(4-methylphenyl)sulfonylanilino)acetamide Traditional Name: 2-(4-chloro-2-methyl-N-tosyl-anilino)-N-[(1R,2R,4R)-norbornan-2-yl]acetamide Formula: C23H27ClN2O3S MolecularWeight: 446.99008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2CC3CCC2C3)C4=C(C=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N[C@@H]2C[C@@H]3CC[C@@H]2C3)C4=C(C=C(C=C4)Cl)C

InChI

InChI=1S/C23H27ClN2O3S/c1-15-3-8-20(9-4-15)30(28,29)26(22-10-7-19(24)11-16(22)2)14-23(27)25-21-13-17-5-6-18(21)12-17/h3-4,7-11,17-18,21H,5-6,12-14H2,1-2H3,(H,25,27)/t17-,18-,21-/m1/s1