N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-2-methyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-2-methyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-2-methyl-5-morpholinosulfonyl-benzamide CAS Name: N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-2-methyl-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-2-methyl-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-2-methyl-5-morpholinosulfonyl-benzamide Formula: C20H30N2O4S MolecularWeight: 394.5282

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@@H]1C)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C20H30N2O4S/c1-14-5-4-6-19(16(14)3)21-20(23)18-13-17(8-7-15(18)2)27(24,25)22-9-11-26-12-10-22/h7-8,13-14,16,19H,4-6,9-12H2,1-3H3,(H,21,23)/t14-,16+,19-/m0/s1