2-[3-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]sulfanylethanamide

Systemtic Name: 2-[3-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]sulfanylethanamide Openeye Name: 2-[3-oxo-3-[4-(4-sec-butylphenyl)sulfonylpiperazin-1-yl]propyl]sulfanylacetamide CAS Name: 2-[[3-[4-(4-butan-2-ylphenyl)sulfonyl-1-piperazinyl]-3-oxopropyl]thio]acetamide IUPAC Name: 2-[3-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-3-oxopropyl]sulfanylacetamide Traditional Name: 2-[[3-keto-3-[4-(4-sec-butylphenyl)sulfonylpiperazino]propyl]thio]acetamide Formula: C19H29N3O4S2 MolecularWeight: 427.58126

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCSCC(=O)N

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCSCC(=O)N

InChI

InChI=1S/C19H29N3O4S2/c1-3-15(2)16-4-6-17(7-5-16)28(25,26)22-11-9-21(10-12-22)19(24)8-13-27-14-18(20)23/h4-7,15H,3,8-14H2,1-2H3,(H2,20,23)