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

Systemtic Name: N-(1-adamantylmethyl)-4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(1-adamantylmethyl)-4-chloro-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(1-adamantylmethyl)-4-chloro-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(1-adamantylmethyl)-4-chloro-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(1-adamantylmethyl)-4-chloro-3-pyrrolidinosulfonyl-benzamide Formula: C22H29ClN2O3S MolecularWeight: 436.99526

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC34CC5CC(C3)CC(C5)C4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC34CC5CC(C3)CC(C5)C4)Cl

InChI

InChI=1S/C22H29ClN2O3S/c23-19-4-3-18(10-20(19)29(27,28)25-5-1-2-6-25)21(26)24-14-22-11-15-7-16(12-22)9-17(8-15)13-22/h3-4,10,15-17H,1-2,5-9,11-14H2,(H,24,26)