N-[2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-2,2-dimethyl-propanamide Openeye Name: 2,2-dimethyl-N-[2-oxo-2-[4-(4-sec-butylphenyl)sulfonylpiperazin-1-yl]ethyl]propanamide CAS Name: N-[2-[4-(4-butan-2-ylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-2,2-dimethylpropanamide IUPAC Name: N-[2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-2,2-dimethylpropanamide Traditional Name: N-[2-keto-2-[4-(4-sec-butylphenyl)sulfonylpiperazino]ethyl]-2,2-dimethyl-propionamide Formula: C21H33N3O4S MolecularWeight: 423.56942

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CNC(=O)C(C)(C)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CNC(=O)C(C)(C)C

InChI

InChI=1S/C21H33N3O4S/c1-6-16(2)17-7-9-18(10-8-17)29(27,28)24-13-11-23(12-14-24)19(25)15-22-20(26)21(3,4)5/h7-10,16H,6,11-15H2,1-5H3,(H,22,26)