N-(1-adamantylmethyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(1-adamantylmethyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(1-adamantylmethyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(1-adamantylmethyl)-2-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(1-adamantylmethyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(1-adamantylmethyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazino]acetamide Formula: C24H35N3O4S MolecularWeight: 461.6174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H35N3O4S/c1-31-21-2-4-22(5-3-21)32(29,30)27-8-6-26(7-9-27)16-23(28)25-17-24-13-18-10-19(14-24)12-20(11-18)15-24/h2-5,18-20H,6-17H2,1H3,(H,25,28)