N-(1-adamantylmethyl)-4-(4-ethanoylphenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-4-(4-ethanoylphenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: 4-(4-acetylphenyl)sulfonyl-N-(1-adamantylmethyl)piperazine-1-carboxamide CAS Name: 4-(4-acetylphenyl)sulfonyl-N-(1-adamantylmethyl)-1-piperazinecarboxamide IUPAC Name: 4-(4-acetylphenyl)sulfonyl-N-(1-adamantylmethyl)piperazine-1-carboxamide Traditional Name: 4-(4-acetylphenyl)sulfonyl-N-(1-adamantylmethyl)piperazine-1-carboxamide Formula: C24H33N3O4S MolecularWeight: 459.60152

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H33N3O4S/c1-17(28)21-2-4-22(5-3-21)32(30,31)27-8-6-26(7-9-27)23(29)25-16-24-13-18-10-19(14-24)12-20(11-18)15-24/h2-5,18-20H,6-16H2,1H3,(H,25,29)