(3,4-dimethoxy-5-prop-2-enyl-phenyl)-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (3,4-dimethoxy-5-prop-2-enyl-phenyl)-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]methanone Openeye Name: (3-allyl-4,5-dimethoxy-phenyl)-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]methanone CAS Name: (3,4-dimethoxy-5-prop-2-enylphenyl)-[4-[(4-methyl-1-piperazinyl)sulfonyl]-1-piperazinyl]methanone IUPAC Name: (3,4-dimethoxy-5-prop-2-enylphenyl)-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]methanone Traditional Name: (3-allyl-4,5-dimethoxy-phenyl)-[4-(4-methylpiperazino)sulfonylpiperazino]methanone Formula: C21H32N4O5S MolecularWeight: 452.56758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C(=C3)OC)OC)CC=C

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C(=C3)OC)OC)CC=C

InChI

InChI=1S/C21H32N4O5S/c1-5-6-17-15-18(16-19(29-3)20(17)30-4)21(26)23-9-13-25(14-10-23)31(27,28)24-11-7-22(2)8-12-24/h5,15-16H,1,6-14H2,2-4H3