2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[4-(4-sec-butylphenyl)sulfonylpiperazin-1-yl]-N-(2-thienylmethyl)acetamide CAS Name: 2-[4-(4-butan-2-ylphenyl)sulfonyl-1-piperazinyl]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[4-(4-sec-butylphenyl)sulfonylpiperazino]-N-(2-thenyl)acetamide Formula: C21H29N3O3S2 MolecularWeight: 435.60326

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NCC3=CC=CS3

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NCC3=CC=CS3

InChI

InChI=1S/C21H29N3O3S2/c1-3-17(2)18-6-8-20(9-7-18)29(26,27)24-12-10-23(11-13-24)16-21(25)22-15-19-5-4-14-28-19/h4-9,14,17H,3,10-13,15-16H2,1-2H3,(H,22,25)