N-(1-adamantyl)-4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(1-adamantyl)-4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(1-adamantyl)-4-chloro-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(1-adamantyl)-4-chloro-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(1-adamantyl)-4-chloro-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(1-adamantyl)-4-chloro-3-pyrrolidinosulfonyl-benzamide Formula: C21H27ClN2O3S MolecularWeight: 422.96868

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC34CC5CC(C3)CC(C5)C4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC34CC5CC(C3)CC(C5)C4)Cl

InChI

InChI=1S/C21H27ClN2O3S/c22-18-4-3-17(10-19(18)28(26,27)24-5-1-2-6-24)20(25)23-21-11-14-7-15(12-21)9-16(8-14)13-21/h3-4,10,14-16H,1-2,5-9,11-13H2,(H,23,25)