N-(1-adamantyl)-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(1-adamantyl)-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(1-adamantyl)-1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-(1-adamantyl)-1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(1-adamantyl)-1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(1-adamantyl)-1-[(5-methyl-2-thienyl)sulfonyl]nipecotamide Formula: C21H30N2O3S2 MolecularWeight: 422.6045

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H30N2O3S2/c1-14-4-5-19(27-14)28(25,26)23-6-2-3-18(13-23)20(24)22-21-10-15-7-16(11-21)9-17(8-15)12-21/h4-5,15-18H,2-3,6-13H2,1H3,(H,22,24)