N-(1-adamantylmethyl)-2-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(1-adamantylmethyl)-2-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(1-adamantylmethyl)-2-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]acetamide CAS Name: N-(1-adamantylmethyl)-2-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]acetamide IUPAC Name: N-(1-adamantylmethyl)-2-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(1-adamantylmethyl)-2-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]acetamide Formula: C21H30ClN3O3S2 MolecularWeight: 472.0642

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NCC23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=C(S5)Cl

Isomeric SMILES

C1CN(CCN1CC(=O)NCC23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=C(S5)Cl

InChI

InChI=1S/C21H30ClN3O3S2/c22-18-1-2-20(29-18)30(27,28)25-5-3-24(4-6-25)13-19(26)23-14-21-10-15-7-16(11-21)9-17(8-15)12-21/h1-2,15-17H,3-14H2,(H,23,26)