(2S)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-1-(4-ethylpiperazin-1-yl)propan-1-one

Systemtic Name: (2S)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-1-(4-ethylpiperazin-1-yl)propan-1-one Openeye Name: (2S)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-1-(4-ethylpiperazin-1-yl)propan-1-one CAS Name: (2S)-2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-1-(4-ethyl-1-piperazinyl)-1-propanone IUPAC Name: (2S)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-1-(4-ethylpiperazin-1-yl)propan-1-one Traditional Name: (2S)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazino]-1-(4-ethylpiperazino)propan-1-one Formula: C21H34N4O3S MolecularWeight: 422.58466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)C)C

Isomeric SMILES

CCN1CCN(CC1)C(=O)[C@H](C)N2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)C)C

InChI

InChI=1S/C21H34N4O3S/c1-5-22-8-10-24(11-9-22)21(26)19(4)23-12-14-25(15-13-23)29(27,28)20-7-6-17(2)16-18(20)3/h6-7,16,19H,5,8-15H2,1-4H3/t19-/m0/s1