2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-1-(4-ethylpiperazin-1-yl)propan-1-one

Systemtic Name: 2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-1-(4-ethylpiperazin-1-yl)propan-1-one Openeye Name: 1-(4-ethylpiperazin-1-yl)-2-(4-indan-5-ylsulfonylpiperazin-1-yl)propan-1-one CAS Name: 2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-1-(4-ethyl-1-piperazinyl)-1-propanone IUPAC Name: 2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-1-(4-ethylpiperazin-1-yl)propan-1-one Traditional Name: 1-(4-ethylpiperazino)-2-(4-indan-5-ylsulfonylpiperazino)propan-1-one Formula: C22H34N4O3S MolecularWeight: 434.59536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

CCN1CCN(CC1)C(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C22H34N4O3S/c1-3-23-9-11-25(12-10-23)22(27)18(2)24-13-15-26(16-14-24)30(28,29)21-8-7-19-5-4-6-20(19)17-21/h7-8,17-18H,3-6,9-16H2,1-2H3